2'Pyrrol-5',N6(4MeOTrityl)dA
TL;DR: 2'Pyrrol-5',N6(4MeOTrityl)dA (CAS 134934-68-2) 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,3R,4R,5R)-2-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-5-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-4-pyrrolidin-1-yloxolan-3-ol
Also Known As: 2'Pyrrol-5',N6(4MeOTrityl)dA, 2'-Pyrrolidino-5',N6-bis(4-methoxytrityl)-2'-deoxyadenosine, 9H-Purin-6-amine, 9-(2-deoxy-5-O-((4-methoxyphenyl)diphenylmethyl)-2-(1-pyrrolidinyl)-beta-D-xylofuranosyl)-N-((4-methoxyphenyl)diphenylmethyl)-, 3'-Morpholino-5'-(4-methoxytrityl)-3'-deoxythymidine, (2R,3R,4R,5R)-2-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-5-[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 | 134934-68-2 |
|---|---|
| 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)O)N1CCCC1 |
| InChIKey | XCYZDKICLPQMOP-JKGXBWLBSA-N |
Product Overview
2'Pyrrol-5',N6(4MeOTrityl)dA (CAS 134934-68-2), with molecular formula C54H52N6O5 and molecular weight 864.40 g/mol. IUPAC: (2R,3R,4R,5R)-2-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-5-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]-4-pyrrolidin-1-yloxolan-3-ol.
Chemical Property Profile of 2'Pyrrol-5',N6(4MeOTrityl)dA
Property Insights of 2'Pyrrol-5',N6(4MeOTrityl)dA
The XLogP value of 9.3 indicates that 2'Pyrrol-5',N6(4MeOTrityl)dA 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 2'Pyrrol-5',N6(4MeOTrityl)dA. Following Lipinski's Rule of Five, 2'Pyrrol-5',N6(4MeOTrityl)dA 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 2'Pyrrol-5',N6(4MeOTrityl)dA?
The CAS number of 2'Pyrrol-5',N6(4MeOTrityl)dA is 134934-68-2.
What is the molecular formula of 2'Pyrrol-5',N6(4MeOTrityl)dA?
The molecular formula of 2'Pyrrol-5',N6(4MeOTrityl)dA is C54H52N6O5.
What is the molecular weight of 2'Pyrrol-5',N6(4MeOTrityl)dA?
The molecular weight of 2'Pyrrol-5',N6(4MeOTrityl)dA is 864.40 g/mol.
Where can I buy 2'Pyrrol-5',N6(4MeOTrityl)dA?
You can request a quote for 2'Pyrrol-5',N6(4MeOTrityl)dA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'Pyrrol-5',N6(4MeOTrityl)dA?
Yes, KEHONG BIO provides custom synthesis services for 2'Pyrrol-5',N6(4MeOTrityl)dA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.