Retinoyl-AZT
TL;DR: Retinoyl-AZT (CAS 125780-97-4) is a chemical compound with molecular formula C30H39N5O5 and molecular weight 549.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
Also Known As: Retinoyl-AZT, AZT Prodrug, Retinoic acid analog, 3'-Azido-3'-deoxythymidine-retinoic acid ester, [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate
| Molecular Formula | C30H39N5O5 |
|---|---|
| Molecular Weight | 549.30 g/mol |
| LogP | 5.88622 |
| Topological Polar Surface Area | 139.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 549.2951 |
| Heavy Atoms | 40 |
| Complexity | 1432.6713 |
Chemical Identifiers
| CAS Number | 125780-97-4 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)OC[C@@H]2[C@H](C[C@@H](O2)N3C=C(C(=O)NC3=O)C)N=[N+]=[N-])/C)/C |
Product Overview
Retinoyl-AZT (CAS 125780-97-4), with molecular formula C30H39N5O5 and molecular weight 549.30 g/mol. IUPAC: [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoate.
Chemical Property Profile of Retinoyl-AZT
Property Insights of Retinoyl-AZT
The XLogP value of 5.88622 indicates that Retinoyl-AZT is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.15 Ų falls within the moderate polarity range, balancing permeability and solubility for Retinoyl-AZT. Following Lipinski's Rule of Five, Retinoyl-AZT has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Retinoyl-AZT?
The CAS number of Retinoyl-AZT is 125780-97-4.
What is the molecular formula of Retinoyl-AZT?
The molecular formula of Retinoyl-AZT is C30H39N5O5.
What is the molecular weight of Retinoyl-AZT?
The molecular weight of Retinoyl-AZT is 549.30 g/mol.
Where can I buy Retinoyl-AZT?
You can request a quote for Retinoyl-AZT directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Retinoyl-AZT?
Yes, KEHONG BIO provides custom synthesis services for Retinoyl-AZT and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.