8,8-dimethyl-4-[(prop-2-en-1-yl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Chemical Structure Depiction of
8,8-dimethyl-4-[(prop-2-en-1-yl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
8,8-dimethyl-4-[(prop-2-en-1-yl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Compound characteristics
| Compound ID: | 5545-0149 |
| Compound Name: | 8,8-dimethyl-4-[(prop-2-en-1-yl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine |
| Molecular Weight: | 343.47 |
| Molecular Formula: | C17 H17 N3 O S2 |
| Smiles: | CC1(C)Cc2c(CO1)cc1c3c(c(ncn3)SCC=C)sc1n2 |
| Stereo: | ACHIRAL |
| logP: | 4.4715 |
| logD: | 4.467 |
| logSw: | -4.4367 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.504 |
| InChI Key: | MBZCESDGZHTWKD-UHFFFAOYSA-N |