5-(4-chlorophenyl)-2-{[(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(4-chlorophenyl)-2-{[(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
5-(4-chlorophenyl)-2-{[(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V031-1690 |
| Compound Name: | 5-(4-chlorophenyl)-2-{[(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 333.84 |
| Molecular Formula: | C16 H16 Cl N3 O S |
| Smiles: | CC(C)NCC1NC(c2c(csc2N=1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2682 |
| logD: | 3.0755 |
| logSw: | -4.2536 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.605 |
| InChI Key: | SWHCVIRYYORFMY-UHFFFAOYSA-N |