2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(diethylamino)-4-methylquinolin-6-yl]acetamide
Chemical Structure Depiction of
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(diethylamino)-4-methylquinolin-6-yl]acetamide
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(diethylamino)-4-methylquinolin-6-yl]acetamide
Compound characteristics
| Compound ID: | C126-0086 |
| Compound Name: | 2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[2-(diethylamino)-4-methylquinolin-6-yl]acetamide |
| Molecular Weight: | 430.89 |
| Molecular Formula: | C20 H23 Cl N6 O3 |
| Smiles: | CCN(CC)c1cc(C)c2cc(ccc2n1)NC(Cn1c(C)c(c(n1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.3543 |
| logD: | 4.3522 |
| logSw: | -4.5865 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.938 |
| InChI Key: | SSBMZILWCQCKJZ-UHFFFAOYSA-N |