ethyl 6-[(4-acetylpiperazin-1-yl)methyl]-2-oxo-1-(prop-2-en-1-yl)-4-(thiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-acetylpiperazin-1-yl)methyl]-2-oxo-1-(prop-2-en-1-yl)-4-(thiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-acetylpiperazin-1-yl)methyl]-2-oxo-1-(prop-2-en-1-yl)-4-(thiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V016-9123 |
| Compound Name: | ethyl 6-[(4-acetylpiperazin-1-yl)methyl]-2-oxo-1-(prop-2-en-1-yl)-4-(thiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C21 H28 N4 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccsc2)NC(N(CC=C)C=1CN1CCN(CC1)C(C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6462 |
| logD: | 1.1937 |
| logSw: | -2.4477 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.949 |
| InChI Key: | VOJLDWMIMDWDEV-IBGZPJMESA-N |