5-amino-4-(4-methoxyphenyl)-1,1-dioxo-7-{3-[(propan-2-yl)oxy]phenyl}-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
Chemical Structure Depiction of
5-amino-4-(4-methoxyphenyl)-1,1-dioxo-7-{3-[(propan-2-yl)oxy]phenyl}-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
5-amino-4-(4-methoxyphenyl)-1,1-dioxo-7-{3-[(propan-2-yl)oxy]phenyl}-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile
Compound characteristics
| Compound ID: | 8017-2510 |
| Compound Name: | 5-amino-4-(4-methoxyphenyl)-1,1-dioxo-7-{3-[(propan-2-yl)oxy]phenyl}-2,3,4,7-tetrahydro-1H-1lambda~6~-thieno[3,2-b]pyridine-6-carbonitrile |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C24 H25 N3 O4 S |
| Smiles: | CC(C)Oc1cccc(c1)C1C(C#N)=C(N)N(C2CCS(C1=2)(=O)=O)c1ccc(cc1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0051 |
| logD: | 3.0051 |
| logSw: | -3.4722 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.367 |
| InChI Key: | RUPBAIZNBBEBSD-QFIPXVFZSA-N |