N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-({N-[3-(2-oxopyrrolidin-1-yl)propyl]glycyl}amino)benzamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-({N-[3-(2-oxopyrrolidin-1-yl)propyl]glycyl}amino)benzamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-({N-[3-(2-oxopyrrolidin-1-yl)propyl]glycyl}amino)benzamide
Compound characteristics
| Compound ID: | C284-0270 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-({N-[3-(2-oxopyrrolidin-1-yl)propyl]glycyl}amino)benzamide |
| Molecular Weight: | 497.51 |
| Molecular Formula: | C24 H27 N5 O7 |
| Smiles: | C1CC(N(C1)CCCNCC(Nc1ccc(cc1C(Nc1ccc2c(c1)OCCO2)=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.383 |
| logD: | -0.4825 |
| logSw: | -2.3742 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 124.105 |
| InChI Key: | DTIWXGNJPLFHIN-UHFFFAOYSA-N |