CRTh2 antagonist 2
TL;DR: CRTh2 antagonist 2 (CAS 780763-95-3) is a chemical compound with molecular formula C26H23ClN4O3 and molecular weight 474.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-chloro-6-(dimethylamino)-2-[[4-(naphthalene-2-carbonylamino)phenyl]methyl]pyrimidin-5-yl]acetic acid
Also Known As: CRTh2 antagonist 2, 2-[4-chloro-6-(dimethylamino)-2-[[4-(naphthalene-2-carbonylamino)phenyl]methyl]pyrimidin-5-yl]acetic acid, (4-chloro-6-(dimethylamino)-2-[4-(2-naphthoylamino)benzyl]pyrimidin-5-yl}acetic acid, {4-chloro-6-(dimethylamino)-2-[4-(2-naphthoylamino)benzyl]pyrimidin-5-yl}acetic acid, 2-(2-(4-(2-Naphthamido)benzyl)-4-chloro-6-(dimethylamino)pyrimidin-5-yl)acetic acid
| Molecular Formula | C26H23ClN4O3 |
|---|---|
| Molecular Weight | 474.15 g/mol |
| LogP | 4.8194 |
| Topological Polar Surface Area | 95.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 474.14587 |
| Heavy Atoms | 34 |
| Complexity | 1370.5992 |
Chemical Identifiers
| CAS Number | 780763-95-3 |
|---|---|
| SMILES | CN(C)C1=C(C(=NC(=N1)CC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)Cl)CC(=O)O |
Product Overview
CRTh2 antagonist 2 (CAS 780763-95-3), with molecular formula C26H23ClN4O3 and molecular weight 474.15 g/mol. IUPAC: 2-[4-chloro-6-(dimethylamino)-2-[[4-(naphthalene-2-carbonylamino)phenyl]methyl]pyrimidin-5-yl]acetic acid.
Chemical Property Profile of CRTh2 antagonist 2
Property Insights of CRTh2 antagonist 2
The XLogP value of 4.8194 indicates that CRTh2 antagonist 2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.42 Ų falls within the moderate polarity range, balancing permeability and solubility for CRTh2 antagonist 2. Following Lipinski's Rule of Five, CRTh2 antagonist 2 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 CRTh2 antagonist 2?
The CAS number of CRTh2 antagonist 2 is 780763-95-3.
What is the molecular formula of CRTh2 antagonist 2?
The molecular formula of CRTh2 antagonist 2 is C26H23ClN4O3.
What is the molecular weight of CRTh2 antagonist 2?
The molecular weight of CRTh2 antagonist 2 is 474.15 g/mol.
Where can I buy CRTh2 antagonist 2?
You can request a quote for CRTh2 antagonist 2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CRTh2 antagonist 2?
Yes, KEHONG BIO provides custom synthesis services for CRTh2 antagonist 2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.