(1-ethyl-1H-pyrazol-3-yl)[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
(1-ethyl-1H-pyrazol-3-yl)[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]methanone--hydrogen chloride (1/1)
(1-ethyl-1H-pyrazol-3-yl)[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | T599-3658 |
| Compound Name: | (1-ethyl-1H-pyrazol-3-yl)[5-(methanesulfonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 384.88 |
| Molecular Formula: | C16 H20 N4 O3 S |
| Salt: | HCl |
| Smiles: | CCn1ccc(C(N2CCCN(c3ccccc23)S(C)(=O)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.9475 |
| logD: | 0.9475 |
| logSw: | -2.0092 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.263 |
| InChI Key: | WVNDYYIKFYQTAF-UHFFFAOYSA-N |