阿巴卡維/拉米夫定
TL;DR: 阿巴卡維/拉米夫定 (CAS 852337-16-7) is a chemical compound with molecular formula C22H29N9O4S and molecular weight 515.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
阿巴卡維/拉米夫定
[(1S,4R)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]methanol;4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one
Also Known As: Epzicom, Kivexa, Ziagen & Epivir, abacavir/lamivudine, Epzicom(TM)
| Molecular Formula | C22H29N9O4S |
|---|---|
| Molecular Weight | 515.21 g/mol |
| LogP | 0.4982 |
| Topological Polar Surface Area | 192.25 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 515.2063 |
| Heavy Atoms | 36 |
| Complexity | 1308.4011 |
Chemical Identifiers
| CAS Number | 852337-16-7 |
|---|---|
| SMILES | C1CC1NC2=C3C(=NC(=N2)N)N(C=N3)[C@@H]4C[C@@H](C=C4)CO.C1[C@H](O[C@H](S1)CO)N2C=CC(=NC2=O)N |
Product Overview
阿巴卡維/拉米夫定 (CAS 852337-16-7), with molecular formula C22H29N9O4S and molecular weight 515.21 g/mol. IUPAC: [(1S,4R)-4-[2-amino-6-(cyclopropylamino)purin-9-yl]cyclopent-2-en-1-yl]methanol;4-amino-1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one.
Chemical Property Profile of 阿巴卡維/拉米夫定
Property Insights of 阿巴卡維/拉米夫定
The XLogP value of 0.4982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 阿巴卡維/拉米夫定. The TPSA of 192.25 Ų indicates high polarity, suggesting 阿巴卡維/拉米夫定 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 阿巴卡維/拉米夫定 has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 阿巴卡維/拉米夫定?
The CAS number of 阿巴卡維/拉米夫定 is 852337-16-7.
What is the molecular formula of 阿巴卡維/拉米夫定?
The molecular formula of 阿巴卡維/拉米夫定 is C22H29N9O4S.
What is the molecular weight of 阿巴卡維/拉米夫定?
The molecular weight of 阿巴卡維/拉米夫定 is 515.21 g/mol.
Where can I buy 阿巴卡維/拉米夫定?
You can request a quote for 阿巴卡維/拉米夫定 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 阿巴卡維/拉米夫定?
Yes, KEHONG BIO provides custom synthesis services for 阿巴卡維/拉米夫定 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.