3-[4-(4-cyanobenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(cyclopropylmethyl)propanamide
Chemical Structure Depiction of
3-[4-(4-cyanobenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(cyclopropylmethyl)propanamide
3-[4-(4-cyanobenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(cyclopropylmethyl)propanamide
Compound characteristics
| Compound ID: | S629-1977 |
| Compound Name: | 3-[4-(4-cyanobenzoyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(cyclopropylmethyl)propanamide |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C24 H25 N3 O3 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(c2ccc(C#N)cc2)=O)c1)C(NCC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6232 |
| logD: | 2.6232 |
| logSw: | -3.0446 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.61 |
| InChI Key: | SENQYJFTFWMNAO-UHFFFAOYSA-N |