3-(4-bromophenyl)-2-methyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9(4H)-one
Chemical Structure Depiction of
3-(4-bromophenyl)-2-methyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9(4H)-one
3-(4-bromophenyl)-2-methyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9(4H)-one
Compound characteristics
| Compound ID: | D718-0251 |
| Compound Name: | 3-(4-bromophenyl)-2-methyl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9(4H)-one |
| Molecular Weight: | 358.24 |
| Molecular Formula: | C17 H16 Br N3 O |
| Smiles: | Cc1c(c2ccc(cc2)[Br])c2NC3CCCCC=3C(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8383 |
| logD: | 3.7826 |
| logSw: | -4.2604 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.039 |
| InChI Key: | CCXRGKPWAQZQGC-UHFFFAOYSA-N |