2-methyl-3-[4-methyl-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)phenyl]-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Chemical Structure Depiction of
2-methyl-3-[4-methyl-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)phenyl]-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
2-methyl-3-[4-methyl-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)phenyl]-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
Compound characteristics
| Compound ID: | L299-0510 |
| Compound Name: | 2-methyl-3-[4-methyl-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)phenyl]-6,7-dihydro-4H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C26 H26 N4 O4 S |
| Smiles: | Cc1ccc(cc1S(N1CCC(=CC1)c1ccccc1)(=O)=O)c1c(C)nn2C(CCC(Nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9612 |
| logD: | 2.6761 |
| logSw: | -3.4506 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.853 |
| InChI Key: | MRSBDRPELQLVIU-UHFFFAOYSA-N |