AR-1C7183
TL;DR: AR-1C7183 (CAS 59202-91-4) is a chemical compound with molecular formula C49H80N2O16 and molecular weight 952.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-aminophenyl)methyl]butanoic acid;14-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-8-ethyl-1-hydroxy-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-2,7,11,13,15,17-hexamethyl-4,6,9,18-tetraoxatricyclo[13.2.1.03,7]octadecane-5,10-dione
Also Known As: 2-(3-aminobenzyl)butanoic acid- 14-{[4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2h-pyran-2-yl]oxy}-8-ethyl-1-hydroxy-12-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2h-pyran-2-yl)oxy]-2,7,11,13,15,17-hexamethyl-4,6,9,18-tetraoxatricyclo[13.2.1.03,7]octadecane-5,10-dione(1:1)(non-preferred name), Erythromycin, 9-deoxo-6,9-epoxy-9-hydroxy-, cyclic 11,12-carbonate, (9S)-, 3-amino-alpha-ethylbenzenepropanoate (salt), Erythromycin, 9-deoxo-6,9-epoxy-9-hydroxy-, cyclic 11,12-carbonate, (9S)-, 3-amino-alpha-ethylbenzenepropanoate
| Molecular Formula | C49H80N2O16 |
|---|---|
| Molecular Weight | 952.55 g/mol |
| LogP | 5.05 |
| Topological Polar Surface Area | 244.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 11 |
| Exact Mass | 952.5508 |
| Heavy Atoms | 67 |
| Complexity | 1510.0 |
Chemical Identifiers
| CAS Number | 59202-91-4 |
|---|---|
| SMILES | CCC1C2(C(C(C3(C(CC(O3)(C(C(C(C(C(=O)O1)C)OC4CC(C(C(O4)C)O)(C)OC)C)OC5C(C(CC(O5)C)N(C)C)O)C)C)O)C)OC(=O)O2)C.CCC(CC1=CC(=CC=C1)N)C(=O)O |
| InChIKey | NMHYWZXJGXZFOP-UHFFFAOYSA-N |
Product Overview
AR-1C7183 (CAS 59202-91-4), with molecular formula C49H80N2O16 and molecular weight 952.55 g/mol. IUPAC: 2-[(3-aminophenyl)methyl]butanoic acid;14-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-8-ethyl-1-hydroxy-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-2,7,11,13,15,17-hexamethyl-4,6,9,18-tetraoxatricyclo[13.2.1.03,7]octadecane-5,10-dione.
Chemical Property Profile of AR-1C7183
Property Insights of AR-1C7183
The XLogP value of 5.05 indicates that AR-1C7183 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 244.0 Ų indicates high polarity, suggesting AR-1C7183 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AR-1C7183 has 5 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AR-1C7183?
The CAS number of AR-1C7183 is 59202-91-4.
What is the molecular formula of AR-1C7183?
The molecular formula of AR-1C7183 is C49H80N2O16.
What is the molecular weight of AR-1C7183?
The molecular weight of AR-1C7183 is 952.55 g/mol.
Where can I buy AR-1C7183?
You can request a quote for AR-1C7183 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AR-1C7183?
Yes, KEHONG BIO provides custom synthesis services for AR-1C7183 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.