N,N-dibenzyl-7-chloro-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
N,N-dibenzyl-7-chloro-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
N,N-dibenzyl-7-chloro-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-1281 |
| Compound Name: | N,N-dibenzyl-7-chloro-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 485 |
| Molecular Formula: | C25 H25 Cl N2 O4 S |
| Smiles: | CS(N1CCC(C(N(Cc2ccccc2)Cc2ccccc2)=O)Oc2ccc(cc12)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.187 |
| logD: | 4.187 |
| logSw: | -4.5101 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.492 |
| InChI Key: | IDTATWGSJISMAE-XMMPIXPASA-N |