N-(4-乙酰氨基苯磺酰基)红霉胺
TL;DR: N-(4-乙酰氨基苯磺酰基)红霉胺 (CAS 57049-06-6) is a chemical compound with molecular formula C45H77N3O15S and molecular weight 931.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-乙酰氨基苯磺酰基)红霉胺
N-[4-[[10-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,9-trihydroxy-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-14-oxo-oxacyclotetradec-6-yl]sulfamoyl]phenyl]acetamide
Also Known As: 2'-Methoxy-6-chlorflavon, N-(4-Acetylaminobenzenesulfonyl)erythromycylamine, (9S)-9-(((4-(Acetylamino)phenyl)sulfonyl)amino)-9-deoxo-erythromycin, -9-[[[4- phenyl]sulfonyl]amino]-9-deoxoerythromycin, Erythromycin, 9-(((4-(acetylamino)phenyl)sulfonyl)amino)-9-deoxo-, (9S)-
| Molecular Formula | C45H77N3O15S |
|---|---|
| Molecular Weight | 931.51 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 260.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 11 |
| Exact Mass | 931.50757 |
| Heavy Atoms | 64 |
| Complexity | 1650.0 |
Chemical Identifiers
| CAS Number | 57049-06-6 |
|---|---|
| SMILES | CCC1C(C(C(C(C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)NS(=O)(=O)C4=CC=C(C=C4)NC(=O)C)C)O)(C)O |
| InChIKey | VFHRYYRWSKRFTO-UHFFFAOYSA-N |
Product Overview
N-(4-乙酰氨基苯磺酰基)红霉胺 (CAS 57049-06-6), with molecular formula C45H77N3O15S and molecular weight 931.51 g/mol. IUPAC: N-[4-[[10-[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,9-trihydroxy-12-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-14-oxo-oxacyclotetradec-6-yl]sulfamoyl]phenyl]acetamide.
Chemical Property Profile of N-(4-乙酰氨基苯磺酰基)红霉胺
Property Insights of N-(4-乙酰氨基苯磺酰基)红霉胺
The XLogP value of 4.2 indicates that N-(4-乙酰氨基苯磺酰基)红霉胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 260.0 Ų indicates high polarity, suggesting N-(4-乙酰氨基苯磺酰基)红霉胺 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-乙酰氨基苯磺酰基)红霉胺 has 7 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-乙酰氨基苯磺酰基)红霉胺?
The CAS number of N-(4-乙酰氨基苯磺酰基)红霉胺 is 57049-06-6.
What is the molecular formula of N-(4-乙酰氨基苯磺酰基)红霉胺?
The molecular formula of N-(4-乙酰氨基苯磺酰基)红霉胺 is C45H77N3O15S.
What is the molecular weight of N-(4-乙酰氨基苯磺酰基)红霉胺?
The molecular weight of N-(4-乙酰氨基苯磺酰基)红霉胺 is 931.51 g/mol.
Where can I buy N-(4-乙酰氨基苯磺酰基)红霉胺?
You can request a quote for N-(4-乙酰氨基苯磺酰基)红霉胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-乙酰氨基苯磺酰基)红霉胺?
Yes, KEHONG BIO provides custom synthesis services for N-(4-乙酰氨基苯磺酰基)红霉胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.