2-[({4-[(propan-2-yl)oxy]phenyl}methyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[({4-[(propan-2-yl)oxy]phenyl}methyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-[({4-[(propan-2-yl)oxy]phenyl}methyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4386-4685 |
| Compound Name: | 2-[({4-[(propan-2-yl)oxy]phenyl}methyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 426.6 |
| Molecular Formula: | C23 H26 N2 O2 S2 |
| Smiles: | CC(C)Oc1ccc(CSC2=Nc3c(C(N2CC=C)=O)c2CCCCc2s3)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3707 |
| logD: | 5.3707 |
| logSw: | -5.2836 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.646 |
| InChI Key: | KRMDQFQNFORMDD-UHFFFAOYSA-N |