2-hydroxy-3-{(3-methylbutyl)[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl]amino}propyl butanoate
Chemical Structure Depiction of
2-hydroxy-3-{(3-methylbutyl)[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl]amino}propyl butanoate
2-hydroxy-3-{(3-methylbutyl)[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl]amino}propyl butanoate
Compound characteristics
| Compound ID: | V022-3727 |
| Compound Name: | 2-hydroxy-3-{(3-methylbutyl)[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)methyl]amino}propyl butanoate |
| Molecular Weight: | 435.59 |
| Molecular Formula: | C22 H33 N3 O4 S |
| Salt: | not_available |
| Smiles: | CCCC(=O)OCC(CN(CCC(C)C)CC1NC(c2c3CCCc3sc2N=1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.672 |
| logD: | 3.6685 |
| logSw: | -4.0525 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.476 |
| InChI Key: | IUQJOZPVHBHXTH-HNNXBMFYSA-N |