3-{1-[(2-amino-2-oxoethyl)sulfanyl]-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-cyclopentylpropanamide
Chemical Structure Depiction of
3-{1-[(2-amino-2-oxoethyl)sulfanyl]-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-cyclopentylpropanamide
3-{1-[(2-amino-2-oxoethyl)sulfanyl]-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-cyclopentylpropanamide
Compound characteristics
| Compound ID: | L942-0120 |
| Compound Name: | 3-{1-[(2-amino-2-oxoethyl)sulfanyl]-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl}-N-cyclopentylpropanamide |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C19 H22 N6 O3 S |
| Smiles: | C1CCC(C1)NC(CCN1C(c2ccccc2n2c1nnc2SCC(N)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7655 |
| logD: | 0.7655 |
| logSw: | -2.2232 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.513 |
| InChI Key: | LUKNIHUBTDUWFR-UHFFFAOYSA-N |