N-(4-methoxyphenyl)-2-[(2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-2-[(2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide
N-(4-methoxyphenyl)-2-[(2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide
Compound characteristics
Compound ID: | K280-0523 |
Compound Name: | N-(4-methoxyphenyl)-2-[(2-methyl[1,2,4]triazolo[1,5-c]quinazolin-5-yl)sulfanyl]butanamide |
Molecular Weight: | 407.49 |
Molecular Formula: | C21 H21 N5 O2 S |
Smiles: | CCC(C(Nc1ccc(cc1)OC)=O)Sc1nc2ccccc2c2nc(C)nn12 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.1439 |
logD: | 4.121 |
logSw: | -4.1627 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.588 |
InChI Key: | CCKGWMTVRHJTHW-UHFFFAOYSA-N |