三磷酸鸟苷
TL;DR: 三磷酸鸟苷 (CAS 86-01-1) is a chemical compound with molecular formula C40H47N5O7 and molecular weight 709.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三磷酸鸟苷
N-[(2S)-4-methyl-1-oxo-1-[[3-oxo-1-[2-(3-pyridin-2-ylphenyl)acetyl]azepan-4-yl]amino]pentan-2-yl]-5-(2-morpholin-4-ylethoxy)-1-benzofuran-2-carboxamide
Also Known As: GUANOSINE TRIPHOSPHATE, N-[(2S)-4-methyl-1-oxo-1-[[3-oxo-1-[2-(3-pyridin-2-ylphenyl)acetyl]azepan-4-yl]amino]pentan-2-yl]-5-(2-morpholin-4-ylethoxy)-1-benzofuran-2-carboxamide
| Molecular Formula | C40H47N5O7 |
|---|---|
| Molecular Weight | 709.35 g/mol |
| LogP | 4.2693 |
| Topological Polar Surface Area | 143.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 709.34753 |
| Heavy Atoms | 52 |
| Complexity | 1853.3494 |
Chemical Identifiers
| CAS Number | 86-01-1 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)NC1CCCN(CC1=O)C(=O)CC2=CC(=CC=C2)C3=CC=CC=N3)NC(=O)C4=CC5=C(O4)C=CC(=C5)OCCN6CCOCC6 |
Product Overview
三磷酸鸟苷 (CAS 86-01-1), with molecular formula C40H47N5O7 and molecular weight 709.35 g/mol. IUPAC: N-[(2S)-4-methyl-1-oxo-1-[[3-oxo-1-[2-(3-pyridin-2-ylphenyl)acetyl]azepan-4-yl]amino]pentan-2-yl]-5-(2-morpholin-4-ylethoxy)-1-benzofuran-2-carboxamide.
Chemical Property Profile of 三磷酸鸟苷
Property Insights of 三磷酸鸟苷
The XLogP value of 4.2693 indicates that 三磷酸鸟苷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.31 Ų indicates high polarity, suggesting 三磷酸鸟苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 三磷酸鸟苷 has 2 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 三磷酸鸟苷?
The CAS number of 三磷酸鸟苷 is 86-01-1.
What is the molecular formula of 三磷酸鸟苷?
The molecular formula of 三磷酸鸟苷 is C40H47N5O7.
What is the molecular weight of 三磷酸鸟苷?
The molecular weight of 三磷酸鸟苷 is 709.35 g/mol.
Where can I buy 三磷酸鸟苷?
You can request a quote for 三磷酸鸟苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三磷酸鸟苷?
Yes, KEHONG BIO provides custom synthesis services for 三磷酸鸟苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.