N-(3-chloro-4-methoxyphenyl)-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
N-(3-chloro-4-methoxyphenyl)-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | C464-1438 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-N~3~-(1-propanoyl-2,3-dihydro-1H-indole-5-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 465.95 |
| Molecular Formula: | C21 H24 Cl N3 O5 S |
| Smiles: | CCC(N1CCc2cc(ccc12)S(NCCC(Nc1ccc(c(c1)[Cl])OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0195 |
| logD: | 3.0173 |
| logSw: | -3.4944 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.041 |
| InChI Key: | SMSNVJDVWUXMCK-UHFFFAOYSA-N |