Fromiamycalin
TL;DR: Fromiamycalin (CAS 163597-73-7) is a chemical compound with molecular formula C45H78N6O5 and molecular weight 782.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: Fromiamycalin, (1S)-1-(1-((2R)-4-amino-2-hydroxybutyl)-1,4,5,6-tetrahydropyrimidin-2-yl)pentadecyl (1's,2R,4'r,5's,6R,7''s,10'r)-7''-ethyl-6-methyl-4'',7''-dihydro-3''h-dispiro(oxane-2,6'-(7,9,12)triazatricyclo(6.3.1.0,)dodecane-10',2''-oxepin)-8'-ene-5'-carboxylic acid, (1S)-1-{1-[(2R)-4-amino-2-hydroxybutyl]-1,4,5,6-tetrahydropyrimidin-2-yl}pentadecyl (1's,2R,4'r,5's,6R,7''s,10'r)-7''-ethyl-6-methyl-4'',7''-dihydro-3''h-dispiro[oxane-2,6'-[7,9,12]triazatricyclo[6.3.1.0,]dodecane-10',2''-oxepin]-8'-ene-5'-carboxylic acid, 15-[1-(4-amino-2-hydroxy-butyl)-5,6-dihydro-4H-pyrimidin-2-yl]pentadecyl ethyl(methyl)dispiro[[?]]carboxylate, Dispiro[oxepin-2(3H),7'-[4H-5,6,8b]triazaacenaphthylene-4'(6'H),2''-[2H]pyran]-3'-carboxylic acid, 7-ethyl-1',2',2'a,3',3'',4,4'',5'',6'',7,8',8'a-dodecahydro-6''-methyl-, 15-[1-(4-amino-2-hydroxybutyl)-1,4,5,6-tetrahydro-2-pyrimidinyl]pentadecyl ester, (2S,2a'R,3'S,4''R,6''R,7S,8a'S)-
| Molecular Formula | C45H78N6O5 |
|---|---|
| Molecular Weight | 782.60 g/mol |
| LogP | 7.7438 |
| Topological Polar Surface Area | 134.24 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 22 |
| Exact Mass | 782.6034 |
| Heavy Atoms | 56 |
| Complexity | 1311.3422 |
Chemical Identifiers
| CAS Number | 163597-73-7 |
|---|---|
| SMILES | CC[C@H]1C=CCC[C@]2(O1)C[C@@H]3CC[C@H]4N3C(=N[C@]5([C@H]4C(=O)OCCCCCCCCCCCCCCCC6=NCCCN6CC(CCN)O)CCC[C@H](O5)C)N2 |
Product Overview
Fromiamycalin (CAS 163597-73-7), with molecular formula C45H78N6O5 and molecular weight 782.60 g/mol.
Chemical Property Profile of Fromiamycalin
Property Insights of Fromiamycalin
The XLogP value of 7.7438 indicates that Fromiamycalin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Fromiamycalin. Following Lipinski's Rule of Five, Fromiamycalin has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Fromiamycalin?
The CAS number of Fromiamycalin is 163597-73-7.
What is the molecular formula of Fromiamycalin?
The molecular formula of Fromiamycalin is C45H78N6O5.
What is the molecular weight of Fromiamycalin?
The molecular weight of Fromiamycalin is 782.60 g/mol.
Where can I buy Fromiamycalin?
You can request a quote for Fromiamycalin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fromiamycalin?
Yes, KEHONG BIO provides custom synthesis services for Fromiamycalin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.