methyl 1-methyl-4-[2-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)pyrrolidine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-methyl-4-[2-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)pyrrolidine-1-sulfonyl]-1H-pyrrole-2-carboxylate
methyl 1-methyl-4-[2-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)pyrrolidine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-0117 |
| Compound Name: | methyl 1-methyl-4-[2-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)pyrrolidine-1-sulfonyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C23 H27 N3 O5 S |
| Smiles: | Cn1cc(cc1C(=O)OC)S(N1CCCC1C(N1CCC(=CC1)c1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0876 |
| logD: | 2.0876 |
| logSw: | -2.676 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.647 |
| InChI Key: | BTCJCEUJWCNGLZ-FQEVSTJZSA-N |