2-{[(3-tert-butoxy-2-hydroxypropyl)(3-methylbutyl)amino]methyl}-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-{[(3-tert-butoxy-2-hydroxypropyl)(3-methylbutyl)amino]methyl}-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
2-{[(3-tert-butoxy-2-hydroxypropyl)(3-methylbutyl)amino]methyl}-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | V018-5947 |
| Compound Name: | 2-{[(3-tert-butoxy-2-hydroxypropyl)(3-methylbutyl)amino]methyl}-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 421.6 |
| Molecular Formula: | C22 H35 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CCN(CC(COC(C)(C)C)O)CC1NC(c2c3CCCc3sc2N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0036 |
| logD: | 4.0024 |
| logSw: | -4.1494 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.655 |
| InChI Key: | VOLGSEDHOXYLLS-HNNXBMFYSA-N |