3-[(5-butyl-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)amino]propan-1-ol
Chemical Structure Depiction of
3-[(5-butyl-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)amino]propan-1-ol
3-[(5-butyl-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)amino]propan-1-ol
Compound characteristics
| Compound ID: | 5921-0080 |
| Compound Name: | 3-[(5-butyl-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)amino]propan-1-ol |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C21 H28 N4 O2 S |
| Smiles: | CCCCc1c2COC(C)(C)Cc2c2c3c(c(NCCCO)ncn3)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7194 |
| logD: | 4.7176 |
| logSw: | -4.7831 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.781 |
| InChI Key: | BNAIPKTZEDKWNE-UHFFFAOYSA-N |