8-(butylsulfanyl)-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Chemical Structure Depiction of
8-(butylsulfanyl)-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
8-(butylsulfanyl)-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Compound characteristics
| Compound ID: | 5921-0008 |
| Compound Name: | 8-(butylsulfanyl)-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine |
| Molecular Weight: | 435.61 |
| Molecular Formula: | C24 H25 N3 O S2 |
| Smiles: | CCCCSc1c2c(c3c4CC(C)(C)OCc4c(c4ccccc4)nc3s2)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 6.9738 |
| logD: | 6.9738 |
| logSw: | -6.1927 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.502 |
| InChI Key: | ZXMLELOXJJHJPL-UHFFFAOYSA-N |