2-(methanesulfonyl)-N-(3-phenylpropyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Chemical Structure Depiction of
2-(methanesulfonyl)-N-(3-phenylpropyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
2-(methanesulfonyl)-N-(3-phenylpropyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Compound characteristics
| Compound ID: | S868-0391 |
| Compound Name: | 2-(methanesulfonyl)-N-(3-phenylpropyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide |
| Molecular Weight: | 375.49 |
| Molecular Formula: | C19 H25 N3 O3 S |
| Smiles: | CS(N1CCCn2c(C1)ccc2C(NCCCc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5262 |
| logD: | 2.5262 |
| logSw: | -2.8157 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.787 |
| InChI Key: | NSMQUJIZZRDUPZ-UHFFFAOYSA-N |