2-({[2-hydroxy-3-(2-methylpropoxy)propyl](prop-2-en-1-yl)amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-({[2-hydroxy-3-(2-methylpropoxy)propyl](prop-2-en-1-yl)amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-({[2-hydroxy-3-(2-methylpropoxy)propyl](prop-2-en-1-yl)amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V014-6665 |
| Compound Name: | 2-({[2-hydroxy-3-(2-methylpropoxy)propyl](prop-2-en-1-yl)amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 405.56 |
| Molecular Formula: | C21 H31 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)COCC(CN(CC=C)CC1NC(c2c3CCCCc3sc2N=1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.102 |
| logD: | 3.1014 |
| logSw: | -3.2626 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.01 |
| InChI Key: | SGLISCIMLYEUAV-HNNXBMFYSA-N |