6-bromo-N-(butan-2-yl)-3-(4-ethylphenyl)-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide
Chemical Structure Depiction of
6-bromo-N-(butan-2-yl)-3-(4-ethylphenyl)-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide
6-bromo-N-(butan-2-yl)-3-(4-ethylphenyl)-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide
Compound characteristics
Compound ID: | C109-0864 |
Compound Name: | 6-bromo-N-(butan-2-yl)-3-(4-ethylphenyl)-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide |
Molecular Weight: | 446.34 |
Molecular Formula: | C21 H24 Br N3 O3 |
Smiles: | CCC(C)NC(C1(c2cc(ccc2NC(N1c1ccc(CC)cc1)=O)[Br])O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.4326 |
logD: | 4.4326 |
logSw: | -4.121 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 66.818 |
InChI Key: | DVSQOHIVWVJDHS-UHFFFAOYSA-N |