ethyl 4-({(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(4-methoxyphenyl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-({(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(4-methoxyphenyl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-({(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(4-methoxyphenyl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G799-0115 |
| Compound Name: | ethyl 4-({(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(4-methoxyphenyl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 493.56 |
| Molecular Formula: | C27 H31 N3 O6 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(cc2)OC)C(Nc2ccc3c(c2)OCCO3)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5869 |
| logD: | 3.5869 |
| logSw: | -3.6923 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.101 |
| InChI Key: | FYDYBINQDIYVIN-UHFFFAOYSA-N |