5-{[(7-bromo-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3-[(1H-indol-3-yl)methyl]imidazo[1,2-c]quinazolin-2(3H)-one
Chemical Structure Depiction of
5-{[(7-bromo-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3-[(1H-indol-3-yl)methyl]imidazo[1,2-c]quinazolin-2(3H)-one
5-{[(7-bromo-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3-[(1H-indol-3-yl)methyl]imidazo[1,2-c]quinazolin-2(3H)-one
Compound characteristics
| Compound ID: | K279-0114 |
| Compound Name: | 5-{[(7-bromo-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-3-[(1H-indol-3-yl)methyl]imidazo[1,2-c]quinazolin-2(3H)-one |
| Molecular Weight: | 583.47 |
| Molecular Formula: | C28 H19 Br N6 O2 S |
| Smiles: | C(C1C(N=C2c3ccccc3N=C(N12)SCC1=CC(N2C=C(C=CC2=N1)[Br])=O)=O)c1c[nH]c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4028 |
| logD: | 3.4012 |
| logSw: | -3.8047 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.528 |
| InChI Key: | FENMWFHIIMSDCW-QHCPKHFHSA-N |