N-{2-[2-(4-methoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-oxoethyl}-N,3-dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Chemical Structure Depiction of
N-{2-[2-(4-methoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-oxoethyl}-N,3-dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
N-{2-[2-(4-methoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-oxoethyl}-N,3-dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Compound characteristics
| Compound ID: | P218-3486 |
| Compound Name: | N-{2-[2-(4-methoxyphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-oxoethyl}-N,3-dimethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide |
| Molecular Weight: | 525.58 |
| Molecular Formula: | C25 H27 N5 O6 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N(C)CC(N1CCCn2c(C1)cc(c1ccc(cc1)OC)n2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1334 |
| logD: | 2.1334 |
| logSw: | -3.0918 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 93.135 |
| InChI Key: | UNJGSSTWGCJAHM-UHFFFAOYSA-N |