3'BuNH-5',N6(4MeOTrityl)dA
TL;DR: 3'BuNH-5',N6(4MeOTrityl)dA (CAS 134934-61-5) is a chemical compound with molecular formula C54H54N6O5 and molecular weight 866.4156 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3S,4S,5S)-4-(butylamino)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]oxolan-3-ol
Also Known As: 3'BuNH-5',N6(4MeOTrityl)dA, 3'-n-Butylamino-5',N6-bis(4-methoxytrityl)-3'-deoxyadenosine, 9H-Purin-6-amine, 9-(3-(butylamino)-3-deoxy-5-O-((4-methoxyphenyl)diphenylmethyl)-beta-D-arabinofuranosyl)-N-((4-methoxyphenyl)diphenylmethyl)-, (2R,3S,4S,5S)-4-(butylamino)-5-[[(4-methoxyphenyl)-diphenyl-methoxy]methyl]-2-[6-[[(4-methoxyphenyl)-diphenyl-methyl]amino]purin-9-yl]tetrahydrofuran-3-ol, (2R,3S,4S,5S)-4-(butylamino)-5-[[(4-methoxyphenyl)-diphenylmethoxy]methyl]-2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]purin-9-yl]oxolan-3-ol
Technical Specifications
| Molecular Formula | C54H54N6O5 |
| Molecular Weight | 866.4156 g/mol |
| XLogP | 9.6 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 18 |
| Exact Mass | 866.4156 Da |
| Heavy Atoms | 65 |
| Complexity | 1350.0 |
| SMILES | CCCCN[C@@H]1[C@H](O[C@H]([C@H]1O)N2C=NC3=C(N=CN=C32)NC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=C(C=C6)OC)COC(C7=CC=CC=C7)(C8=CC=CC=C8)C9=CC=C(C=C9)OC |
| InChIKey | JHXMZCFCDRQRMF-OMWPHUTCSA-N |
Chemical Property Profile of 3'BuNH-5',N6(4MeOTrityl)dA
Property Insights of 3'BuNH-5',N6(4MeOTrityl)dA
The XLogP value of 9.6 indicates that 3'BuNH-5',N6(4MeOTrityl)dA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'BuNH-5',N6(4MeOTrityl)dA. Following Lipinski's Rule of Five, 3'BuNH-5',N6(4MeOTrityl)dA has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3'BuNH-5',N6(4MeOTrityl)dA?
The CAS number of 3'BuNH-5',N6(4MeOTrityl)dA is 134934-61-5.
What is the molecular formula of 3'BuNH-5',N6(4MeOTrityl)dA?
The molecular formula of 3'BuNH-5',N6(4MeOTrityl)dA is C54H54N6O5.
What is the molecular weight of 3'BuNH-5',N6(4MeOTrityl)dA?
The molecular weight of 3'BuNH-5',N6(4MeOTrityl)dA is 866.4156 g/mol.
Where can I buy 3'BuNH-5',N6(4MeOTrityl)dA?
You can request a quote for 3'BuNH-5',N6(4MeOTrityl)dA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3'BuNH-5',N6(4MeOTrityl)dA?
Yes, CoreyChem provides custom synthesis services for 3'BuNH-5',N6(4MeOTrityl)dA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.