3-{[(4-bromothiophen-2-yl)methyl]amino}-2-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
3-{[(4-bromothiophen-2-yl)methyl]amino}-2-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one
3-{[(4-bromothiophen-2-yl)methyl]amino}-2-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | 3651-6194 |
| Compound Name: | 3-{[(4-bromothiophen-2-yl)methyl]amino}-2-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 472.36 |
| Molecular Formula: | C21 H18 Br N3 O3 S |
| Smiles: | COc1ccc(cc1OC)C1=Nc2ccccc2C(N1NCc1cc(cs1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3812 |
| logD: | 3.3812 |
| logSw: | -3.8341 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.155 |
| InChI Key: | UXZNZQBRMDQWNA-UHFFFAOYSA-N |