1-[(2-methylphenyl)methyl]-3-({[3-(2-oxopyrrolidin-1-yl)propyl]amino}methyl)-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2-methylphenyl)methyl]-3-({[3-(2-oxopyrrolidin-1-yl)propyl]amino}methyl)-1H-indole-2-carboxylic acid
1-[(2-methylphenyl)methyl]-3-({[3-(2-oxopyrrolidin-1-yl)propyl]amino}methyl)-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C753-0413 |
| Compound Name: | 1-[(2-methylphenyl)methyl]-3-({[3-(2-oxopyrrolidin-1-yl)propyl]amino}methyl)-1H-indole-2-carboxylic acid |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C25 H29 N3 O3 |
| Smiles: | Cc1ccccc1Cn1c(C(O)=O)c(CNCCCN2CCCC2=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.6128 |
| logD: | 2.6128 |
| logSw: | -2.6903 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.996 |
| InChI Key: | ZPBRJKFNFJMSJP-UHFFFAOYSA-N |