(1,5-dimethyl-1H-pyrazol-3-yl)[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]methanone
Chemical Structure Depiction of
(1,5-dimethyl-1H-pyrazol-3-yl)[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]methanone
(1,5-dimethyl-1H-pyrazol-3-yl)[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]methanone
Compound characteristics
| Compound ID: | T599-3660F |
| Compound Name: | (1,5-dimethyl-1H-pyrazol-3-yl)[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]methanone |
| Molecular Weight: | 348.42 |
| Molecular Formula: | C16 H20 N4 O3 S |
| Smiles: | Cc1cc(C(N2CCCN(c3ccccc23)S(C)(=O)=O)=O)nn1C |
| Stereo: | ACHIRAL |
| logP: | 0.8307 |
| logD: | 0.8307 |
| logSw: | -2.0557 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.365 |
| InChI Key: | ZJUOQYZVKQOJBR-UHFFFAOYSA-N |