4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-cycloheptylbutanamide
Chemical Structure Depiction of
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-cycloheptylbutanamide
4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-cycloheptylbutanamide
Compound characteristics
| Compound ID: | K284-4077 |
| Compound Name: | 4-(6-bromo-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-cycloheptylbutanamide |
| Molecular Weight: | 438.39 |
| Molecular Formula: | C19 H24 Br N3 O2 S |
| Smiles: | C1CCCC(CC1)NC(CCCN1C(c2cc(ccc2NC1=S)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0286 |
| logD: | 3.9638 |
| logSw: | -4.1253 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.824 |
| InChI Key: | SDRCDUCLEQXTEB-UHFFFAOYSA-N |