C20H25Cl2N5
TL;DR: C20H25Cl2N5 (CAS 98189-71-0) is a chemical compound with molecular formula C20H25Cl2N5 and molecular weight 405.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-2,6-dimethyl-5-prop-2-enylpyrimidin-4-amine
Also Known As: (E)-4-((2-(5-allyl-2,6-dimethylpyrimidin-4-yl)hydrazono)methyl)-N,N-bis(2-chloroethyl)aniline, N,N-bis(2-chloroethyl)-4-[(E)-{2-[2,6-dimethyl-5-(prop-2-en-1-yl)pyrimidin-4-yl]hydrazinylidene}methyl]aniline
| Molecular Formula | C20H25Cl2N5 |
|---|---|
| Molecular Weight | 405.15 g/mol |
| LogP | 4.55194 |
| Topological Polar Surface Area | 53.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 405.1487 |
| Heavy Atoms | 27 |
| Complexity | 768.6867 |
Chemical Identifiers
| CAS Number | 98189-71-0 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)C)N/N=C/C2=CC=C(C=C2)N(CCCl)CCCl)CC=C |
Product Overview
C20H25Cl2N5 (CAS 98189-71-0), with molecular formula C20H25Cl2N5 and molecular weight 405.15 g/mol. IUPAC: N-[(E)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-2,6-dimethyl-5-prop-2-enylpyrimidin-4-amine.
Chemical Property Profile of C20H25Cl2N5
Property Insights of C20H25Cl2N5
The XLogP value of 4.55194 indicates that C20H25Cl2N5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.41 Ų, C20H25Cl2N5 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C20H25Cl2N5 has 1 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 C20H25Cl2N5?
The CAS number of C20H25Cl2N5 is 98189-71-0.
What is the molecular formula of C20H25Cl2N5?
The molecular formula of C20H25Cl2N5 is C20H25Cl2N5.
What is the molecular weight of C20H25Cl2N5?
The molecular weight of C20H25Cl2N5 is 405.15 g/mol.
Where can I buy C20H25Cl2N5?
You can request a quote for C20H25Cl2N5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C20H25Cl2N5?
Yes, KEHONG BIO provides custom synthesis services for C20H25Cl2N5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.