AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate
TL;DR: AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate (CAS 32455-51-9) is a chemical compound with molecular formula C20H27ClN7O6P and molecular weight 527.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-N-[[4-[2-chloroethyl(methyl)amino]phenyl]methyl]phosphonamidic acid
Also Known As: Amp-cmb, Amp-4-(N-2-chloroethyl-N-methylamino)benzylamidate, Adenosine monophosphate-4-(N-2-chloroethyl-N-methylamino)benzylamidate, [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-N-[[4-[2-chloroethyl(methyl)amino]phenyl]methyl]phosphonamidic acid, Adenosine, 5'-(hydrogen(p-((2-chloroethyl)methylamino)benzyl)phosphoramidate)
| Molecular Formula | C20H27ClN7O6P |
|---|---|
| Molecular Weight | 527.14 g/mol |
| LogP | 0.6095 |
| Topological Polar Surface Area | 181.11 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 527.1449 |
| Heavy Atoms | 35 |
| Complexity | 1198.425 |
Chemical Identifiers
| CAS Number | 32455-51-9 |
|---|---|
| SMILES | CN(CCCl)C1=CC=C(C=C1)CNP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O |
Product Overview
AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate (CAS 32455-51-9), with molecular formula C20H27ClN7O6P and molecular weight 527.14 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-N-[[4-[2-chloroethyl(methyl)amino]phenyl]methyl]phosphonamidic acid.
Chemical Property Profile of AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate
Property Insights of AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate
The XLogP value of 0.6095 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate. The TPSA of 181.11 Ų indicates high polarity, suggesting AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate?
The CAS number of AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate is 32455-51-9.
What is the molecular formula of AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate?
The molecular formula of AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate is C20H27ClN7O6P.
What is the molecular weight of AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate?
The molecular weight of AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate is 527.14 g/mol.
Where can I buy AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate?
You can request a quote for AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate?
Yes, KEHONG BIO provides custom synthesis services for AMP-4-(N-2-chloroethyl-N-methylamino)benzylamidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.