methyl 3-{[(1-benzyl-1H-pyrrol-2-yl)methyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 3-{[(1-benzyl-1H-pyrrol-2-yl)methyl]carbamamido}benzoate
methyl 3-{[(1-benzyl-1H-pyrrol-2-yl)methyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | G331-0074 |
| Compound Name: | methyl 3-{[(1-benzyl-1H-pyrrol-2-yl)methyl]carbamamido}benzoate |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C21 H21 N3 O3 |
| Smiles: | COC(c1cccc(c1)NC(NCc1cccn1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0807 |
| logD: | 4.0807 |
| logSw: | -4.288 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.108 |
| InChI Key: | UJQLWJZQMHEQAH-UHFFFAOYSA-N |