AB00668263-01
TL;DR: AB00668263-01 (CAS 450345-48-9) is a chemical compound with molecular formula C17H11Cl2N5O3 and molecular weight 403.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(6-amino-5-nitropyrimidin-4-yl)amino]-5-chlorophenyl]-(2-chlorophenyl)methanone
Also Known As: AB00668263-01, F0543-0147, N4-[4-CHLORO-2-(2-CHLOROBENZOYL)PHENYL]-5-NITROPYRIMIDINE-4,6-DIAMINE, (2-((6-amino-5-nitropyrimidin-4-yl)amino)-5-chlorophenyl)(2-chlorophenyl)methanone, (2-(6-amino-5-nitropyrimidin-4-ylamino)-5-chlorophenyl)(2-chlorophenyl)methanone
| Molecular Formula | C17H11Cl2N5O3 |
|---|---|
| Molecular Weight | 403.02 g/mol |
| LogP | 4.2484 |
| Topological Polar Surface Area | 124.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.0239 |
| Heavy Atoms | 27 |
| Complexity | 1058.4889 |
Chemical Identifiers
| CAS Number | 450345-48-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)NC3=NC=NC(=C3[N+](=O)[O-])N)Cl |
Product Overview
AB00668263-01 (CAS 450345-48-9), with molecular formula C17H11Cl2N5O3 and molecular weight 403.02 g/mol. IUPAC: [2-[(6-amino-5-nitropyrimidin-4-yl)amino]-5-chlorophenyl]-(2-chlorophenyl)methanone.
Chemical Property Profile of AB00668263-01
Property Insights of AB00668263-01
The XLogP value of 4.2484 indicates that AB00668263-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668263-01. Following Lipinski's Rule of Five, AB00668263-01 has 2 hydrogen bond donor(s) and 7 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 AB00668263-01?
The CAS number of AB00668263-01 is 450345-48-9.
What is the molecular formula of AB00668263-01?
The molecular formula of AB00668263-01 is C17H11Cl2N5O3.
What is the molecular weight of AB00668263-01?
The molecular weight of AB00668263-01 is 403.02 g/mol.
Where can I buy AB00668263-01?
You can request a quote for AB00668263-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668263-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668263-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.