3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine
TL;DR: 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine (CAS 134963-35-2) is a chemical compound with molecular formula C54H52N6O5 and molecular weight 864.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4S,5S)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-4-pyrrolidin-1-yloxolan-3-ol
Also Known As: 3'Pyrrol-5',N6(4MeOTrityl)dA, 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine, (2R,3S,4S,5S)-5-(((4-Methoxyphenyl)diphenylmethoxy)methyl)-2-(6-(((4-methoxyphenyl)diphenylmethyl)amino)-9H-purin-9-yl)-4-(pyrrolidin-1-yl)tetrahydrofuran-3-ol, (2R,3S,4S,5S)-5-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-2-[6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]-4-pyrrolidin-1-yl-tetrahydrofuran-3-ol, (2R,3S,4S,5S)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-4-pyrrolidin-1-yloxolan-3-ol
| Molecular Formula | C54H52N6O5 |
|---|---|
| Molecular Weight | 864.40 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 864.3999 |
| Heavy Atoms | 65 |
| Complexity | 1390.0 |
Chemical Identifiers
| CAS Number | 134963-35-2 |
|---|---|
| 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@@H]([C@H](O6)COC(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=C(C=C9)OC)N1CCCC1)O |
| InChIKey | LNVWSYVFRVXGFD-JKGXBWLBSA-N |
Product Overview
3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine (CAS 134963-35-2), with molecular formula C54H52N6O5 and molecular weight 864.40 g/mol. IUPAC: (2R,3S,4S,5S)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-4-pyrrolidin-1-yloxolan-3-ol.
Chemical Property Profile of 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine
Property Insights of 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine
The XLogP value of 9.3 indicates that 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine. Following Lipinski's Rule of Five, 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine has 2 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 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine?
The CAS number of 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine is 134963-35-2.
What is the molecular formula of 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine?
The molecular formula of 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine is C54H52N6O5.
What is the molecular weight of 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine?
The molecular weight of 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine is 864.40 g/mol.
Where can I buy 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine?
You can request a quote for 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine?
Yes, KEHONG BIO provides custom synthesis services for 3'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.