N-cyclopentyl-N'-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea
Chemical Structure Depiction of
N-cyclopentyl-N'-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea
N-cyclopentyl-N'-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea
Compound characteristics
| Compound ID: | L785-0046 |
| Compound Name: | N-cyclopentyl-N'-(5-{[(3-oxo-3,4-dihydroquinoxalin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)urea |
| Molecular Weight: | 402.5 |
| Molecular Formula: | C17 H18 N6 O2 S2 |
| Smiles: | C1CCC(C1)NC(Nc1nnc(SCC2C(Nc3ccccc3N=2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1755 |
| logD: | 3.1755 |
| logSw: | -3.6641 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.479 |
| InChI Key: | PPISPLJQSQIKBP-UHFFFAOYSA-N |