N-(3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-(3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-(3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-0833 |
| Compound Name: | N-(3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C26 H31 N3 O2 |
| Smiles: | C1CCC(CCNC(c2cccc(c2)NC(N2CCCCc3ccccc23)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.4673 |
| logD: | 5.4673 |
| logSw: | -5.739 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.15 |
| InChI Key: | IHUPHWKXNFLOOV-UHFFFAOYSA-N |