methyl 4-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzoate
Chemical Structure Depiction of
methyl 4-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzoate
methyl 4-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzoate
Compound characteristics
Compound ID: | 8007-7886 |
Compound Name: | methyl 4-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-1,4-dihydroquinazolin-3(2H)-yl]benzoate |
Molecular Weight: | 402.41 |
Molecular Formula: | C23 H18 N2 O5 |
Smiles: | COC(c1ccc(cc1)N1C(c2ccc3c(c2)OCO3)Nc2ccccc2C1=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.3449 |
logD: | 4.3449 |
logSw: | -4.4029 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.021 |
InChI Key: | NKWZLMSQZKCRLF-NRFANRHFSA-N |