2-(benzylsulfanyl)-3-(3-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-3-(3-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
2-(benzylsulfanyl)-3-(3-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
Compound ID: | G859-0297 |
Compound Name: | 2-(benzylsulfanyl)-3-(3-methoxyphenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one |
Molecular Weight: | 471.58 |
Molecular Formula: | C27 H25 N3 O3 S |
Smiles: | COc1cccc(c1)N1C(=Nc2cc(ccc2C1=O)C(N1CCCC1)=O)SCc1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.9244 |
logD: | 3.9242 |
logSw: | -4.0072 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 49.718 |
InChI Key: | HDZBGLPYOUEXCB-UHFFFAOYSA-N |