3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[3-(diethylamino)propyl]benzamide
Chemical Structure Depiction of
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[3-(diethylamino)propyl]benzamide
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[3-(diethylamino)propyl]benzamide
Compound characteristics
| Compound ID: | K288-0436 |
| Compound Name: | 3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-[3-(diethylamino)propyl]benzamide |
| Molecular Weight: | 444.98 |
| Molecular Formula: | C22 H25 Cl N4 O2 S |
| Smiles: | CCN(CC)CCCNC(c1cccc(c1)N1C(c2ccc(cc2NC1=S)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3132 |
| logD: | 3.3132 |
| logSw: | -3.8229 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.644 |
| InChI Key: | ZJFLCMSWUBXNTP-UHFFFAOYSA-N |