N-[(3-methoxyphenyl)methyl]-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
N-[(3-methoxyphenyl)methyl]-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
Compound characteristics
| Compound ID: | G114-0140 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C22 H24 N2 O5 S |
| Smiles: | COc1cccc(CNC(CCS(c2cc3CCC(N4CCc(c2)c34)=O)(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.0817 |
| logD: | 2.0817 |
| logSw: | -2.7582 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.621 |
| InChI Key: | TXKOVAKTTALJPB-UHFFFAOYSA-N |