N-(3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
Chemical Structure Depiction of
N-(3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
N-(3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide
Compound characteristics
Compound ID: | G795-0215 |
Compound Name: | N-(3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-1,2-benzothiazole-3-carboxamide |
Molecular Weight: | 405.52 |
Molecular Formula: | C23 H23 N3 O2 S |
Smiles: | C1CCC(CCNC(c2cccc(c2)NC(c2c3ccccc3sn2)=O)=O)=CC1 |
Stereo: | ACHIRAL |
logP: | 4.8244 |
logD: | 4.8244 |
logSw: | -4.9287 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 58.767 |
InChI Key: | HOEQEPDSBHUEBJ-UHFFFAOYSA-N |