(3S)-7-{[cyclopropyl(methanesulfonyl)amino]methyl}-3-methyl-N-propyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
(3S)-7-{[cyclopropyl(methanesulfonyl)amino]methyl}-3-methyl-N-propyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
(3S)-7-{[cyclopropyl(methanesulfonyl)amino]methyl}-3-methyl-N-propyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S978-0672 |
| Compound Name: | (3S)-7-{[cyclopropyl(methanesulfonyl)amino]methyl}-3-methyl-N-propyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 395.52 |
| Molecular Formula: | C19 H29 N3 O4 S |
| Smiles: | CCCNC(N1Cc2cc(CN(C3CC3)S(C)(=O)=O)ccc2OC[C@@H]1C)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.1032 |
| logD: | 3.1032 |
| logSw: | -3.4199 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.352 |
| InChI Key: | PQPCPSYPXHKVPT-AWEZNQCLSA-N |