N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-[(2-methoxyphenyl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-[(2-methoxyphenyl)methyl]-beta-alaninamide
N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-[(2-methoxyphenyl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | G849-0081 |
| Compound Name: | N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-[(2-methoxyphenyl)methyl]-beta-alaninamide |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C23 H27 N3 O5 S |
| Smiles: | COc1ccccc1CNC(CCNS(c1ccc2c(CCN2C(C2CC2)=O)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6079 |
| logD: | 2.6078 |
| logSw: | -3.2175 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.142 |
| InChI Key: | PVDQNAOEDPBPJL-UHFFFAOYSA-N |