Ervafolidene
TL;DR: Ervafolidene (CAS 84716-74-5) is a chemical compound with molecular formula C40H46N4O4 and molecular weight 646.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,20-diethyl-38-hydroxy-4-oxa-6,16,24,34-tetrazaundecacyclo[25.10.1.113,16.01,24.03,23.05,13.05,22.07,12.027,35.028,33.020,39]nonatriaconta-7,9,11,18,28,30,32,35-octaene-36-carboxylate
Also Known As: Ervafolidene, 14a,21a-Methano-8H,11H,24H-indolizino(8,1-cd)indolo(2''',3''':5'',6'')azocino(1'',2'':1',5')pyrrolo(2',3':4,5)furo(2,3-m)carbazole-20-carboxylicacid, 10a,22a-diethyl-5,6,10a,10b,11a,11b,13,14,19,21,22,22a-dodecahydro-,methyl ester, (4bR,10aR,10bS,11aS,11bS,14aR,21aS,22aS,23aR,25S)-, Methyl 10a,22a-diethyl-25-hydroxy-5,6,10a,11,11a,11b,13,14,19,21,22,22a-dodecahydro-8H,10bH,24H-14a,21a-methanoindolizino[8,1-cd]indolo[2''',3''':5'',6'']azocino[1'',2'':1',5']pyrrolo[2',3':4,5]furo[2,3-m]carbazole-20-carboxylate, Methyl 12a,24a-diethyl-25-hydroxy-5,6,12a,14,16,21,22,23a,23b,24,24a,24b-dodecahydro-3H,11H,13H-13a,20b-methanoindolizino[8,1-cd]indolo[2''',3''':5'',6'']azocino[1'',2'':1',5']pyrrolo[2',3':4,5]furo[2,3-m]carbazole-15-carboxylate
| Molecular Formula | C40H46N4O4 |
|---|---|
| Molecular Weight | 646.35 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 86.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 646.3519 |
| Heavy Atoms | 48 |
| Complexity | 1520.0 |
Chemical Identifiers
| CAS Number | 84716-74-5 |
|---|---|
| SMILES | CCC12CC3C4C(CC56N4CCC7(C5O)C8=CC=CC=C8NC7=C(C6)C(=O)OC)(OC39C3(C1N(CC3)CC=C2)C1=CC=CC=C1N9)CC |
| InChIKey | HFYQMINRWXPMOM-UHFFFAOYSA-N |
Product Overview
Ervafolidene (CAS 84716-74-5), with molecular formula C40H46N4O4 and molecular weight 646.35 g/mol. IUPAC: methyl 3,20-diethyl-38-hydroxy-4-oxa-6,16,24,34-tetrazaundecacyclo[25.10.1.113,16.01,24.03,23.05,13.05,22.07,12.027,35.028,33.020,39]nonatriaconta-7,9,11,18,28,30,32,35-octaene-36-carboxylate.
Chemical Property Profile of Ervafolidene
Property Insights of Ervafolidene
The XLogP value of 5.3 indicates that Ervafolidene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Ervafolidene. Following Lipinski's Rule of Five, Ervafolidene has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ervafolidene?
The CAS number of Ervafolidene is 84716-74-5.
What is the molecular formula of Ervafolidene?
The molecular formula of Ervafolidene is C40H46N4O4.
What is the molecular weight of Ervafolidene?
The molecular weight of Ervafolidene is 646.35 g/mol.
Where can I buy Ervafolidene?
You can request a quote for Ervafolidene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ervafolidene?
Yes, KEHONG BIO provides custom synthesis services for Ervafolidene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.