2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl (3,4-dichlorophenyl)carbamate
Chemical Structure Depiction of
2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl (3,4-dichlorophenyl)carbamate
2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl (3,4-dichlorophenyl)carbamate
Compound characteristics
Compound ID: | 3332-0197 |
Compound Name: | 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl (3,4-dichlorophenyl)carbamate |
Molecular Weight: | 359.17 |
Molecular Formula: | C13 H12 Cl2 N4 O4 |
Smiles: | Cc1ncc([N+]([O-])=O)n1CCOC(Nc1ccc(c(c1)[Cl])[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.6344 |
logD: | 3.5021 |
logSw: | -3.7212 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.405 |
InChI Key: | LZBIFAWBTFUUTJ-UHFFFAOYSA-N |