ddA analog
TL;DR: ddA analog (CAS 134963-32-9) is a chemical compound with molecular formula C54H52N6O4 and molecular weight 848.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[(2R,3R,5S)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-3-pyrrolidin-1-yloxolan-2-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine
Also Known As: ddA analog, 2'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-2',3'-dideoxyadenosine, Adenosine, 2',3'-dideoxy-N-((4-methoxyphenyl)diphenylmethyl)-5'-O-((4-methoxyphenyl)diphenylmethyl)-2'-(1-pyrrolidinyl)-, 9-[(2R,3R,5S)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-3-pyrrolidin-1-yloxolan-2-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine, 2',3'-Dideoxy-N-[(4-methoxyphenyl)di(phenyl)methyl]-5'-O-[(4-methoxyphenyl)di(phenyl)methyl]-2'-(pyrrolidin-1-yl)adenosine
| Molecular Formula | C54H52N6O4 |
|---|---|
| Molecular Weight | 848.40 g/mol |
| LogP | 10.3 |
| Topological Polar Surface Area | 95.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 15 |
| Exact Mass | 848.405 |
| Heavy Atoms | 64 |
| Complexity | 1360.0 |
Chemical Identifiers
| CAS Number | 134963-32-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC4=C5C(=NC=N4)N(C=N5)[C@H]6[C@@H](C[C@H](O6)COC(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=C(C=C9)OC)N1CCCC1 |
| InChIKey | YGFDRZUCFRUOTP-WHCCNUDUSA-N |
Product Overview
ddA analog (CAS 134963-32-9), with molecular formula C54H52N6O4 and molecular weight 848.40 g/mol. IUPAC: 9-[(2R,3R,5S)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-3-pyrrolidin-1-yloxolan-2-yl]-N-[(4-methoxyphenyl)-diphenylmethyl]purin-6-amine.
Chemical Property Profile of ddA analog
Property Insights of ddA analog
The XLogP value of 10.3 indicates that ddA analog is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.8 Ų falls within the moderate polarity range, balancing permeability and solubility for ddA analog. Following Lipinski's Rule of Five, ddA analog has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ddA analog?
The CAS number of ddA analog is 134963-32-9.
What is the molecular formula of ddA analog?
The molecular formula of ddA analog is C54H52N6O4.
What is the molecular weight of ddA analog?
The molecular weight of ddA analog is 848.40 g/mol.
Where can I buy ddA analog?
You can request a quote for ddA analog directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ddA analog?
Yes, KEHONG BIO provides custom synthesis services for ddA analog and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.