![2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide structure](/static/products/799/799807-83-3.png)
2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide
TL;DR: 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide (CAS 799807-83-3) is a chemical compound with molecular formula C18H17BrN4OS2 and molecular weight 448.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N'-(2-methylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)benzohydrazide
Also Known As: 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide, 2-bromo-N'-(2-methylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)benzohydrazide, 2-bromo-N'-[2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]benzohydrazide
| Molecular Formula | C18H17BrN4OS2 |
|---|---|
| Molecular Weight | 448.00 g/mol |
| LogP | 4.8114 |
| Topological Polar Surface Area | 66.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.00272 |
| Heavy Atoms | 26 |
| Complexity | 988.7267 |
Chemical Identifiers
| CAS Number | 799807-83-3 |
|---|---|
| SMILES | CSC1=NC(=C2C3=C(CCCC3)SC2=N1)NNC(=O)C4=CC=CC=C4Br |
Product Overview
2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide (CAS 799807-83-3), with molecular formula C18H17BrN4OS2 and molecular weight 448.00 g/mol. IUPAC: 2-bromo-N'-(2-methylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)benzohydrazide.
Chemical Property Profile of 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide
Property Insights of 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide
The XLogP value of 4.8114 indicates that 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide. Following Lipinski's Rule of Five, 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide?
The CAS number of 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide is 799807-83-3.
What is the molecular formula of 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide?
The molecular formula of 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide is C18H17BrN4OS2.
What is the molecular weight of 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide?
The molecular weight of 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide is 448.00 g/mol.
Where can I buy 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide?
You can request a quote for 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-N'-(2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)benzohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.