(E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime
TL;DR: (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime (CAS 27466-70-2) is a chemical compound with molecular formula C19H26Cl2N4O and molecular weight 396.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dimethylamino)propyl]prop-2-enamide
Also Known As: (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime, 3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dimethylamino)propyl]prop-2-enamide, 2-Propenamide,3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-n-[3-(dimethylamino)propyl]-, 3-{4-[Bis(2-chloroethyl)amino]phenyl}-2-cyano-N-[3-(dimethylamino)propyl]prop-2-enimidic acid
| Molecular Formula | C19H26Cl2N4O |
|---|---|
| Molecular Weight | 396.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 396.14838 |
| Heavy Atoms | 26 |
| Complexity | 487.0 |
Chemical Identifiers
| CAS Number | 27466-70-2 |
|---|---|
| SMILES | CN(C)CCCNC(=O)C(=CC1=CC=C(C=C1)N(CCCl)CCCl)C#N |
| InChIKey | PUJHEWCXJNZDCX-UHFFFAOYSA-N |
Product Overview
(E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime (CAS 27466-70-2), with molecular formula C19H26Cl2N4O and molecular weight 396.15 g/mol. IUPAC: 3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dimethylamino)propyl]prop-2-enamide.
Chemical Property Profile of (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime
Property Insights of (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime
The XLogP value of 3.3 indicates that (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.4 Ų, (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime has 1 hydrogen bond donor(s) and 4 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 (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime?
The CAS number of (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime is 27466-70-2.
What is the molecular formula of (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime?
The molecular formula of (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime is C19H26Cl2N4O.
What is the molecular weight of (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime?
The molecular weight of (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime is 396.15 g/mol.
Where can I buy (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime?
You can request a quote for (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-[4-[bis(2-chloroethyl)amino]phenyl]-2-cyano-N-[3-(dime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.