[4-chloro-2-(1H-tetrazol-1-yl)phenyl](8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone
Chemical Structure Depiction of
[4-chloro-2-(1H-tetrazol-1-yl)phenyl](8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone
[4-chloro-2-(1H-tetrazol-1-yl)phenyl](8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone
Compound characteristics
Compound ID: | Y041-6167 |
Compound Name: | [4-chloro-2-(1H-tetrazol-1-yl)phenyl](8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)methanone |
Molecular Weight: | 408.85 |
Molecular Formula: | C20 H17 Cl N6 O2 |
Smiles: | COc1ccc2c(c1)c1CN(CCc1[nH]2)C(c1ccc(cc1n1cnnn1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 2.5216 |
logD: | 2.5216 |
logSw: | -3.5195 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.407 |
InChI Key: | MPYBXYKAVCBPKC-UHFFFAOYSA-N |