N-[(3-bromophenyl)methyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
N-[(3-bromophenyl)methyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | J035-0468 |
| Compound Name: | N-[(3-bromophenyl)methyl]-8,8-dimethyl-6-oxo-6,7,8,9-tetrahydropyrazolo[1,5-a]quinazoline-3-carboxamide |
| Molecular Weight: | 427.3 |
| Molecular Formula: | C20 H19 Br N4 O2 |
| Smiles: | CC1(C)CC2=C(C=Nc3c(cnn23)C(NCc2cccc(c2)[Br])=O)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5806 |
| logD: | 3.5804 |
| logSw: | -3.6843 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.062 |
| InChI Key: | QPOOFNRYTWZJQK-UHFFFAOYSA-N |