2-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-6-iodo-3-(2-methylphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-6-iodo-3-(2-methylphenyl)quinazolin-4(3H)-one
2-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-6-iodo-3-(2-methylphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | IB08-1919 |
| Compound Name: | 2-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-6-iodo-3-(2-methylphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 482.77 |
| Molecular Formula: | C19 H16 Cl I N2 O S |
| Smiles: | C/C(=C\CSC1=Nc2ccc(cc2C(N1c1ccccc1C)=O)I)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.34 |
| logD: | 6.34 |
| logSw: | -7.49 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 76.48 |
| InChI Key: | NFVHBVLQUSYLKW-UHFFFAOYSA-N |