4-methyl-9-nitro-1,3-dihydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
4-methyl-9-nitro-1,3-dihydro-2H-1,5-benzodiazepin-2-one
4-methyl-9-nitro-1,3-dihydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | 8010-3056 |
| Compound Name: | 4-methyl-9-nitro-1,3-dihydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 219.2 |
| Molecular Formula: | C10 H9 N3 O3 |
| Smiles: | CC1CC(Nc2c(cccc2[N+]([O-])=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7194 |
| logD: | 0.4892 |
| logSw: | -2.0744 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.304 |
| InChI Key: | QXJIZBSAEXMJRQ-UHFFFAOYSA-N |