Cambridge id 6952236
TL;DR: Cambridge id 6952236 (CAS 683798-89-2) is a chemical compound with molecular formula C20H16ClN3O2S and molecular weight 397.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoic acid;hydrochloride
Also Known As: 3-[[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoic acid hydrochloride, Cambridge id 6952236
| Molecular Formula | C20H16ClN3O2S |
|---|---|
| Molecular Weight | 397.07 g/mol |
| LogP | 5.53032 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.0652 |
| Heavy Atoms | 27 |
| Complexity | 1109.8779 |
Chemical Identifiers
| CAS Number | 683798-89-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NC4=CC=CC(=C4)C(=O)O.Cl |
Product Overview
Cambridge id 6952236 (CAS 683798-89-2), with molecular formula C20H16ClN3O2S and molecular weight 397.07 g/mol. IUPAC: 3-[[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]amino]benzoic acid;hydrochloride.
Chemical Property Profile of Cambridge id 6952236
Property Insights of Cambridge id 6952236
The XLogP value of 5.53032 indicates that Cambridge id 6952236 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Cambridge id 6952236. Following Lipinski's Rule of Five, Cambridge id 6952236 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cambridge id 6952236?
The CAS number of Cambridge id 6952236 is 683798-89-2.
What is the molecular formula of Cambridge id 6952236?
The molecular formula of Cambridge id 6952236 is C20H16ClN3O2S.
What is the molecular weight of Cambridge id 6952236?
The molecular weight of Cambridge id 6952236 is 397.07 g/mol.
Where can I buy Cambridge id 6952236?
You can request a quote for Cambridge id 6952236 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 6952236?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 6952236 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.