![N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine structure](/static/products/797/797-03-5.png)
N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine
TL;DR: N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine (CAS 797-03-5) is a chemical compound with molecular formula C15H17Cl2N5 and molecular weight 337.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine
Also Known As: NCIOpen2_007832, N-[(Z)-[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]p, N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine
| Molecular Formula | C15H17Cl2N5 |
|---|---|
| Molecular Weight | 337.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 53.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 337.0861 |
| Heavy Atoms | 22 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 797-03-5 |
|---|---|
| SMILES | C1=CN=C(N=C1)NN=CC2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | QRHJAHSNTXASJS-UHFFFAOYSA-N |
Product Overview
N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine (CAS 797-03-5), with molecular formula C15H17Cl2N5 and molecular weight 337.09 g/mol. IUPAC: N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine.
Chemical Property Profile of N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine
Property Insights of N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine
The XLogP value of 3.5 indicates that N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.4 Ų, N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine 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 N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine?
The CAS number of N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine is 797-03-5.
What is the molecular formula of N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine?
The molecular formula of N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine is C15H17Cl2N5.
What is the molecular weight of N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine?
The molecular weight of N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine is 337.09 g/mol.
Where can I buy N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine?
You can request a quote for N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]pyrimidin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.