2-({(3-tert-butoxy-2-hydroxypropyl)[(furan-2-yl)methyl]amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-({(3-tert-butoxy-2-hydroxypropyl)[(furan-2-yl)methyl]amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-({(3-tert-butoxy-2-hydroxypropyl)[(furan-2-yl)methyl]amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V016-8607 |
| Compound Name: | 2-({(3-tert-butoxy-2-hydroxypropyl)[(furan-2-yl)methyl]amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C23 H31 N3 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)OCC(CN(CC1NC(c2c3CCCCc3sc2N=1)=O)Cc1ccco1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6942 |
| logD: | 3.6928 |
| logSw: | -4.1947 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.788 |
| InChI Key: | MDBHUZYSHQHXOX-HNNXBMFYSA-N |