Free Chemical Databases
-
[Synonyms]
Oprea1_526649
Oprea1_743933
MLS000712128
SBB007063
ZINC00193067
BAS 00599022
SMR000281895
AG-690/36545027
5-(2,4-Dichloro-phenyl)-[1,3,4]thiadiazol-2-ylamine
28004-63-9
[Structure]
[ Properties Computed from Structure]
Molecular Weight 246.1164 [g/mol] Molecular Formula C8H5Cl2N3S XLogP 3.6 H-Bond Donor 1 H-Bond Acceptor 3 Rotatable Bond Count 1 Tautomer Count 2 Exact Mass 244.958123 MonoIsotopic Mass 244.958123 Topological Polar Surface Area 51.8 Heavy Atom Count 14 Formal Charge 0 Complexity 207 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 0 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: 5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-amine
Canonical SMILES: C1=CC(=C(C=C1Cl)Cl)C2=NN=C(S2)N
InChI: InChI=1/C8H5Cl2N3S/c9-4-1-2-5(6(10)3-4)7-12-13-8(11)14-7/h1-3H,(H2,11,
13)/f/h11H2
Other Chemicals
- NSC320592,91860-16-1,
- Tyloindicine F,NSC650393,NCI60_017549,8a(1H)-Indolizinol, 6-(3,4-dimethoxyphenyl)-2,3,5,6-tetrahydro- 7-(4-met
- NSC288719,74420-08-9,
- NSC367112
- IUPAC Name: 2-cyano-3-[[[(2,,6-dimethylphenyl)amino]-sulfanylmethylidene]amino]prop-2-enamide,Canonical SMILES
- NSC699990,NCI60_035872,
- NSC649597
- NSC677050,AIDS147430,AIDS-147430,NCI60_027435,Methyl 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-hydroxy-1,2,3,6,7,8
- NSC222609,28122-53-4,
- IUPAC Name: 8-(2-methoxyethoxymethoxy)oct-2-en-3-yl-trimethylsilane,Canonical SMILES: CC=C(CCCCCOCOCCOC)[Si](C
- 1,2-4-Triazine deriv.,NSC658726,AIDS051037,AIDS-051037,NCI60_020653,2,2-bis(5-Oxospiro[1H,4H-1,2,4-triazine-6,
- NSC699709,NCI60_035679,
- NSC669692
- NSC620528,NCI60_006073,
- NSC201785
- AIDS018254,AIDS-018254,NSC403683,2,6-Dimethyl-p-dithiane, 1,1,4,4,-tetroxide,
- IUPAC Name: 7-but-2-enyl-3-methyl-1,2-dihydropyrazolo[4,5-d]pyridazin-4-one,Canonical SMILES: CC=CCC1=C2C(=C(N
- Oprea1_582310,AIDS343471,AIDS-343471,NSC409919,IVK/9034426,Benzoic acid, 2,5-dihydroxy-, hydrazide,15791-90-9,
- NSC241599
- Isocolchicine analog,AIDS002909,AIDS-002909,Benzo[a]heptalene, acetamide deriv.,N-Deacetyltrifluoroacetylisoco
- NSC643482,AIDS137898,N,N'-Dibenzyl-N''-cyanoguanidine,AIDS-137898,NCI60_014718,
- HONOKIOL DIMETHYL ETHER,NSC293102,68592-18-7,
- Squamone,NSC695409,NCI60_034164,
- NSC373268
- NSC305818,88756-23-4,
- NSC266190,AIDS128344,AIDS-128344,NSC 266190,1,2,2-Triphenylvinyl trifluoromethanesulfonate,24764-60-1,
- IUPAC Name: 2-hydroxy-2-phenylacetic acid; tributylstannane,Canonical SMILES: CCCC[SnH](CCCC)CCCC.C1=CC=C(C=C1
- NSC666487,AIDS144280,AIDS-144280,10-Phenyl-5,10-dihydrophenophosphazine,NCI60_023148,
- NSC678156,AIDS147865,AIDS-147865,NCI60_028004,2-(4-Benzoylphenyl)-N-(3-oxo-3-(4-(4-(3-(2.lambda.~5~-1,2-triaza
- NSC711139