RefChem:380918
TL;DR: RefChem:380918 (CAS 64058-50-0) is a chemical compound with molecular formula C24H27NO6 and molecular weight 425.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxalic acid;1-(spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-4-ylmethyl)pyrrolidine
Also Known As: KST-1B7061, 1519 CB, 1-(10,11-dihydrospiro[dibenzo[a,d][7]annulene-5,2'-[1,3]dioxolan]-4'-ylmethyl)pyrrolidineethanedioate(1:1), Spiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane), 10,11-dihydro-4'-(1-pyrrolidinyl)methyl-, oxalate, sodium,6-[[3-carboxy-1-(2-hydroxyphenyl)-3-oxopropyl]amino]naphthalene-1-sulfonate
| Molecular Formula | C24H27NO6 |
|---|---|
| Molecular Weight | 425.18 g/mol |
| LogP | 2.65 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 425.18384 |
| Heavy Atoms | 31 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 64058-50-0 |
|---|---|
| SMILES | C1CCN(C1)CC2COC3(O2)C4=CC=CC=C4CCC5=CC=CC=C35.C(=O)(C(=O)O)O |
| InChIKey | MWWMGCVBMPQZDD-UHFFFAOYSA-N |
Product Overview
RefChem:380918 (CAS 64058-50-0), with molecular formula C24H27NO6 and molecular weight 425.18 g/mol. IUPAC: oxalic acid;1-(spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-4-ylmethyl)pyrrolidine.
Chemical Property Profile of RefChem:380918
Property Insights of RefChem:380918
The XLogP value of 2.65 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:380918. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:380918. Following Lipinski's Rule of Five, RefChem:380918 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:380918?
The CAS number of RefChem:380918 is 64058-50-0.
What is the molecular formula of RefChem:380918?
The molecular formula of RefChem:380918 is C24H27NO6.
What is the molecular weight of RefChem:380918?
The molecular weight of RefChem:380918 is 425.18 g/mol.
Where can I buy RefChem:380918?
You can request a quote for RefChem:380918 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:380918?
Yes, KEHONG BIO provides custom synthesis services for RefChem:380918 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.