2-(3-chloro-4-methoxybenzene-1-sulfonyl)-1-[4-(methylsulfanyl)phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Chemical Structure Depiction of
2-(3-chloro-4-methoxybenzene-1-sulfonyl)-1-[4-(methylsulfanyl)phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
2-(3-chloro-4-methoxybenzene-1-sulfonyl)-1-[4-(methylsulfanyl)phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Compound characteristics
| Compound ID: | C700-2620 |
| Compound Name: | 2-(3-chloro-4-methoxybenzene-1-sulfonyl)-1-[4-(methylsulfanyl)phenyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole |
| Molecular Weight: | 499.05 |
| Molecular Formula: | C25 H23 Cl N2 O3 S2 |
| Smiles: | COc1ccc(cc1[Cl])S(N1CCc2c3ccccc3[nH]c2C1c1ccc(cc1)SC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9954 |
| logD: | 5.9954 |
| logSw: | -6.293 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.542 |
| InChI Key: | DLLYVUNNQXXYDW-RUZDIDTESA-N |