3-[(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)amino]-3-(3,5-difluorophenyl)propanoic acid
Chemical Structure Depiction of
3-[(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)amino]-3-(3,5-difluorophenyl)propanoic acid
3-[(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)amino]-3-(3,5-difluorophenyl)propanoic acid
Compound characteristics
| Compound ID: | E992-0419 |
| Compound Name: | 3-[(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)amino]-3-(3,5-difluorophenyl)propanoic acid |
| Molecular Weight: | 438.45 |
| Molecular Formula: | C20 H20 F2 N2 O5 S |
| Smiles: | CC1Cc2cc(ccc2N1C(C)=O)S(NC(CC(O)=O)c1cc(cc(c1)F)F)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.458 |
| logD: | -0.3429 |
| logSw: | -2.7077 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.581 |
| InChI Key: | ZDDFEPZSNGKCEB-UHFFFAOYSA-N |