8-{[(4-chlorophenyl)methyl]sulfanyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Chemical Structure Depiction of
8-{[(4-chlorophenyl)methyl]sulfanyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
8-{[(4-chlorophenyl)methyl]sulfanyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Compound characteristics
| Compound ID: | E513-0106 |
| Compound Name: | 8-{[(4-chlorophenyl)methyl]sulfanyl}thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine |
| Molecular Weight: | 331.84 |
| Molecular Formula: | C15 H10 Cl N3 S2 |
| Smiles: | C(c1ccc(cc1)[Cl])Sc1c2cc3c(ccs3)n2cnn1 |
| Stereo: | ACHIRAL |
| logP: | 3.8821 |
| logD: | 3.8816 |
| logSw: | -4.3911 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.9432 |
| InChI Key: | CMGLYKQZSBFNGA-UHFFFAOYSA-N |