4-tert-butyl-N-{4-[(tetrazolo[1,5-a]quinoxalin-4-yl)sulfanyl]phenyl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{4-[(tetrazolo[1,5-a]quinoxalin-4-yl)sulfanyl]phenyl}benzamide
4-tert-butyl-N-{4-[(tetrazolo[1,5-a]quinoxalin-4-yl)sulfanyl]phenyl}benzamide
Compound characteristics
| Compound ID: | L433-0033 |
| Compound Name: | 4-tert-butyl-N-{4-[(tetrazolo[1,5-a]quinoxalin-4-yl)sulfanyl]phenyl}benzamide |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C25 H22 N6 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1ccc(cc1)Sc1c2nnnn2c2ccccc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.08 |
| logD: | 6.0798 |
| logSw: | -5.6411 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.776 |
| InChI Key: | XWWDBEJQAPGINI-UHFFFAOYSA-N |