ethyl 4-(2H-1,3-benzodioxol-5-yl)-3-[(2-chloropyridine-3-carbonyl)amino]-1-methyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-(2H-1,3-benzodioxol-5-yl)-3-[(2-chloropyridine-3-carbonyl)amino]-1-methyl-1H-pyrrole-2-carboxylate
ethyl 4-(2H-1,3-benzodioxol-5-yl)-3-[(2-chloropyridine-3-carbonyl)amino]-1-methyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V016-7174 |
| Compound Name: | ethyl 4-(2H-1,3-benzodioxol-5-yl)-3-[(2-chloropyridine-3-carbonyl)amino]-1-methyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 427.84 |
| Molecular Formula: | C21 H18 Cl N3 O5 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(c(cn1C)c1ccc2c(c1)OCO2)NC(c1cccnc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6987 |
| logD: | 0.8045 |
| logSw: | -3.6525 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.303 |
| InChI Key: | RDJNGVUUDUNPBN-UHFFFAOYSA-N |