2-[2-amino-1-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrrol-3-yl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-[2-amino-1-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrrol-3-yl]quinazolin-4(3H)-one
2-[2-amino-1-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrrol-3-yl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | D416-0475 |
| Compound Name: | 2-[2-amino-1-(3,4-dimethoxyphenyl)-4-oxo-4,5-dihydro-1H-pyrrol-3-yl]quinazolin-4(3H)-one |
| Molecular Weight: | 378.39 |
| Molecular Formula: | C20 H18 N4 O4 |
| Smiles: | COc1ccc(cc1OC)N1CC(C(=C1N)C1NC(c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9236 |
| logD: | -0.5912 |
| logSw: | -2.5817 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.884 |
| InChI Key: | UMUMMNNQORBQST-UHFFFAOYSA-N |