N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide
TL;DR: N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide (CAS 5455-86-7) is a chemical compound with molecular formula C14H11Cl2N6OP and molecular weight 380.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-[[(5-chloropyrimidin-2-yl)amino]-phenylphosphoryl]pyrimidin-2-amine
Also Known As: N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide, 5-chloro-N-[[(5-chloropyrimidin-2-yl)amino]-phenylphosphoryl, N,N'-Bis(5-chloropyrimidin-2-yl)-P-phenylphosphonic diamide, 5-chloro-N-[[(5-chloropyrimidin-2-yl)amino]-phenylphosphoryl]pyrimidin-2-amine
| Molecular Formula | C14H11Cl2N6OP |
|---|---|
| Molecular Weight | 380.01 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.0109 |
| Heavy Atoms | 24 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 5455-86-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)P(=O)(NC2=NC=C(C=N2)Cl)NC3=NC=C(C=N3)Cl |
| InChIKey | WYVYAVCSIZYGBK-UHFFFAOYSA-N |
Product Overview
N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide (CAS 5455-86-7), with molecular formula C14H11Cl2N6OP and molecular weight 380.01 g/mol. IUPAC: 5-chloro-N-[[(5-chloropyrimidin-2-yl)amino]-phenylphosphoryl]pyrimidin-2-amine.
Chemical Property Profile of N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide
Property Insights of N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide
The XLogP value of 3.2 indicates that N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide. Following Lipinski's Rule of Five, N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide 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 N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide?
The CAS number of N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide is 5455-86-7.
What is the molecular formula of N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide?
The molecular formula of N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide is C14H11Cl2N6OP.
What is the molecular weight of N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide?
The molecular weight of N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide is 380.01 g/mol.
Where can I buy N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide?
You can request a quote for N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide?
Yes, KEHONG BIO provides custom synthesis services for N,N'-Bis(5-chloro-2-pyrimidinyl)-P-phenylphosphonic diamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.