N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-ethyl-2-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Chemical Structure Depiction of
N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-ethyl-2-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-ethyl-2-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide
Compound characteristics
| Compound ID: | S868-0408 |
| Compound Name: | N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-ethyl-2-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-7-carboxamide |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C18 H27 N5 O3 S |
| Smiles: | CCN(Cc1cnn(C)c1C)C(c1ccc2CN(CCCn12)S(C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6966 |
| logD: | 0.6966 |
| logSw: | -1.9966 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.955 |
| InChI Key: | DTBGJWXXDQKVLL-UHFFFAOYSA-N |