3-bromo-N-[2-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]benzamide
Chemical Structure Depiction of
3-bromo-N-[2-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]benzamide
3-bromo-N-[2-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]benzamide
Compound characteristics
| Compound ID: | K292-2072 |
| Compound Name: | 3-bromo-N-[2-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]benzamide |
| Molecular Weight: | 509.44 |
| Molecular Formula: | C20 H21 Br N4 O3 S2 |
| Smiles: | CC(C)CCNC(CSC1=Nc2ccsc2C(N1NC(c1cccc(c1)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5396 |
| logD: | 3.5366 |
| logSw: | -3.8942 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.775 |
| InChI Key: | FQLVUQVKXXIQAP-UHFFFAOYSA-N |