RefChem:380920
TL;DR: RefChem:380920 (CAS 64036-63-1) is a chemical compound with molecular formula C24H29NO6 and molecular weight 427.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxalic acid;N-(spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-4-ylmethyl)butan-2-amine
Also Known As: Spiro(5H-dibenzo(a,d)cycloheptene-5,2'-(1',3')dioxolane), 10,11-dihydro-4'-(sec-butylamino)methyl-, oxalate, n-(10,11-dihydrospiro[dibenzo[a,d][7]annulene-5,2'-[1,3]dioxolan]-4'-ylmethyl)butan-2-amine ethanedioate(1:1), Oxalic acid--N-[(10,11-dihydrospiro[dibenzo[a,d][7]annulene-5,2'-[1,3]dioxolan]-4'-yl)methyl]butan-2-amine (1/1), Spiro[5H-dibenzo[a,d]cycloheptene-5,2'-[1,3]dioxolane]-4'-methanamine, 10,11-dihydro-N-(1-methylpropyl)-, ethanedioate (1:1), RefChem:380920
| Molecular Formula | C24H29NO6 |
|---|---|
| Molecular Weight | 427.20 g/mol |
| LogP | 2.95 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.1995 |
| Heavy Atoms | 31 |
| Complexity | 487.0 |
Chemical Identifiers
| CAS Number | 64036-63-1 |
|---|---|
| SMILES | CCC(C)NCC1COC2(O1)C3=CC=CC=C3CCC4=CC=CC=C24.C(=O)(C(=O)O)O |
| InChIKey | FOPVWIQJESKKKW-UHFFFAOYSA-N |
Product Overview
RefChem:380920 (CAS 64036-63-1), with molecular formula C24H29NO6 and molecular weight 427.20 g/mol. IUPAC: oxalic acid;N-(spiro[1,3-dioxolane-2,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-4-ylmethyl)butan-2-amine.
Chemical Property Profile of RefChem:380920
Property Insights of RefChem:380920
The XLogP value of 2.95 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:380920. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:380920. Following Lipinski's Rule of Five, RefChem:380920 has 3 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:380920?
The CAS number of RefChem:380920 is 64036-63-1.
What is the molecular formula of RefChem:380920?
The molecular formula of RefChem:380920 is C24H29NO6.
What is the molecular weight of RefChem:380920?
The molecular weight of RefChem:380920 is 427.20 g/mol.
Where can I buy RefChem:380920?
You can request a quote for RefChem:380920 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:380920?
Yes, KEHONG BIO provides custom synthesis services for RefChem:380920 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.