N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide
TL;DR: N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide (CAS 316362-58-0) is a chemical compound with molecular formula C17H16N4O2S and molecular weight 340.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-anilino-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)formamide
Also Known As: N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide, N-(2-anilino-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)formamide
| Molecular Formula | C17H16N4O2S |
|---|---|
| Molecular Weight | 340.10 g/mol |
| LogP | 2.7803 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 340.0994 |
| Heavy Atoms | 24 |
| Complexity | 962.1213 |
Chemical Identifiers
| CAS Number | 316362-58-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)NC=O)NC4=CC=CC=C4 |
Product Overview
N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide (CAS 316362-58-0), with molecular formula C17H16N4O2S and molecular weight 340.10 g/mol. IUPAC: N-(2-anilino-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)formamide.
Chemical Property Profile of N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide
Property Insights of N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide
The XLogP value of 2.7803 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide. Following Lipinski's Rule of Five, N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide has 2 hydrogen bond donor(s) and 5 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 N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide?
The CAS number of N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide is 316362-58-0.
What is the molecular formula of N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide?
The molecular formula of N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide is C17H16N4O2S.
What is the molecular weight of N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide?
The molecular weight of N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide is 340.10 g/mol.
Where can I buy N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide?
You can request a quote for N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-oxo-2-(phenylamino)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)formamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.