N-(4-chlorophenyl)-N'-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea
Chemical Structure Depiction of
N-(4-chlorophenyl)-N'-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea
N-(4-chlorophenyl)-N'-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea
Compound characteristics
| Compound ID: | L785-0003 |
| Compound Name: | N-(4-chlorophenyl)-N'-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea |
| Molecular Weight: | 444.92 |
| Molecular Formula: | C18 H13 Cl N6 O2 S2 |
| Smiles: | C(C1C(Nc2ccccc2N=1)=O)Sc1nnc(NC(Nc2ccc(cc2)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.6133 |
| logD: | 4.6131 |
| logSw: | -4.9917 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.066 |
| InChI Key: | FWOBLGCGZLHIBA-UHFFFAOYSA-N |