N-(bicyclo[2.2.1]heptan-2-yl)-7-chloro-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
N-(bicyclo[2.2.1]heptan-2-yl)-7-chloro-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
N-(bicyclo[2.2.1]heptan-2-yl)-7-chloro-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-1335 |
| Compound Name: | N-(bicyclo[2.2.1]heptan-2-yl)-7-chloro-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 398.91 |
| Molecular Formula: | C18 H23 Cl N2 O4 S |
| Smiles: | CS(N1CCC(C(NC2CC3CCC2C3)=O)Oc2ccc(cc12)[Cl])(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1329 |
| logD: | 3.1329 |
| logSw: | -3.6855 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.734 |
| InChI Key: | FIHZKTAGBXEHIW-UHFFFAOYSA-N |