3-{ethyl[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl]amino}-2-hydroxypropyl butanoate
Chemical Structure Depiction of
3-{ethyl[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl]amino}-2-hydroxypropyl butanoate
3-{ethyl[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl]amino}-2-hydroxypropyl butanoate
Compound characteristics
| Compound ID: | V014-6709 |
| Compound Name: | 3-{ethyl[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl]amino}-2-hydroxypropyl butanoate |
| Molecular Weight: | 393.5 |
| Molecular Formula: | C19 H27 N3 O4 S |
| Salt: | not_available |
| Smiles: | CCCC(=O)OCC(CN(CC)CC1NC(c2c3CCCc3sc2N=1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3938 |
| logD: | 2.3897 |
| logSw: | -2.7377 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.223 |
| InChI Key: | YTEADQJBKBIPOM-LBPRGKRZSA-N |