ARBONATE, (4A_,9_,10_,10Abeta)-
TL;DR: ARBONATE, (4A_,9_,10_,10Abeta)- (CAS 53447-04-4) is a chemical compound with molecular formula C16H20N2O4 and molecular weight 304.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(10-carbamoyloxy-4b,5,6,7,8,8a,9,10-octahydrophenanthren-9-yl) carbamate
Also Known As: ARBONATE, (4A_,9_,10_,10Abeta)-, 1,2,3,4,4a,9,10,10a-Octahydrophenanthrene-9,10-diyl dicarbamate, (10-carbamoyloxy-4b,5,6,7,8,8a,9,10-octahydrophenanthren-9-yl) carbamate, 9a,10a-Dihydroxy-1,2,3,4,4a,9,10,10a-(trans-4a,10a)-octahydrophenanthrene dicarbamate, 9E,10a-Dihydroxy-1,2,3,4,4a,9,10,10a-(trans-4a,10a)-octahydrophenanthrene dicarbamate
| Molecular Formula | C16H20N2O4 |
|---|---|
| Molecular Weight | 304.14 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.1423 |
| Heavy Atoms | 22 |
| Complexity | 442.0 |
Chemical Identifiers
| CAS Number | 53447-04-4 |
|---|---|
| SMILES | C1CCC2C(C1)C(C(C3=CC=CC=C23)OC(=O)N)OC(=O)N |
| InChIKey | YHLGHBVUFLZEBN-UHFFFAOYSA-N |
Product Overview
ARBONATE, (4A_,9_,10_,10Abeta)- (CAS 53447-04-4), with molecular formula C16H20N2O4 and molecular weight 304.14 g/mol. IUPAC: (10-carbamoyloxy-4b,5,6,7,8,8a,9,10-octahydrophenanthren-9-yl) carbamate.
Chemical Property Profile of ARBONATE, (4A_,9_,10_,10Abeta)-
Property Insights of ARBONATE, (4A_,9_,10_,10Abeta)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ARBONATE, (4A_,9_,10_,10Abeta)-. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ARBONATE, (4A_,9_,10_,10Abeta)-. Following Lipinski's Rule of Five, ARBONATE, (4A_,9_,10_,10Abeta)- has 2 hydrogen bond donor(s) and 4 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 ARBONATE, (4A_,9_,10_,10Abeta)-?
The CAS number of ARBONATE, (4A_,9_,10_,10Abeta)- is 53447-04-4.
What is the molecular formula of ARBONATE, (4A_,9_,10_,10Abeta)-?
The molecular formula of ARBONATE, (4A_,9_,10_,10Abeta)- is C16H20N2O4.
What is the molecular weight of ARBONATE, (4A_,9_,10_,10Abeta)-?
The molecular weight of ARBONATE, (4A_,9_,10_,10Abeta)- is 304.14 g/mol.
Where can I buy ARBONATE, (4A_,9_,10_,10Abeta)-?
You can request a quote for ARBONATE, (4A_,9_,10_,10Abeta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ARBONATE, (4A_,9_,10_,10Abeta)-?
Yes, KEHONG BIO provides custom synthesis services for ARBONATE, (4A_,9_,10_,10Abeta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.