N-(3-chlorophenyl)-5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F736-1026 |
Compound Name: | N-(3-chlorophenyl)-5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 396.92 |
Molecular Formula: | C16 H17 Cl N4 O2 S2 |
Smiles: | C1CCC(C1)NC(CSc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.6673 |
logD: | 3.6663 |
logSw: | -4.0586 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.486 |
InChI Key: | IYWWYLOVUMEHTN-UHFFFAOYSA-N |