RefChem:294813
TL;DR: RefChem:294813 (CAS 50708-90-2) is a chemical compound with molecular formula C30H46ClNO4S and molecular weight 551.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,4-dimethyl-7-(3-methyloctan-2-yl)-1,2-dihydrothieno[2,3-c]chromen-9-yl] 4-morpholin-4-ylbutanoate;hydrochloride
Also Known As: 4-Morpholinebutanoic acid, 7-(1,2-dimethylheptyl)-1,4-dihydro-4,4-dimethyl-2H-thieno(2,3-c)(1)benzopyran-9-yl ester, hydrochloride, [4,4-dimethyl-7-(3-methyloctan-2-yl)-1,2-dihydrothieno[2,3-c]chromen-9-yl] 4-morpholin-4-ylbutanoate hydrochloride, 4,4-Dimethyl-7-(3-methyloctan-2-yl)-1,4-dihydro-2H-thieno[2,3-c][1]benzopyran-9-yl 4-(morpholin-4-yl)butanoate--hydrogen chloride (1/1), RefChem:294813
| Molecular Formula | C30H46ClNO4S |
|---|---|
| Molecular Weight | 551.28 g/mol |
| LogP | 7.4651 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 551.2836 |
| Heavy Atoms | 37 |
| Complexity | 957.1449 |
Chemical Identifiers
| CAS Number | 50708-90-2 |
|---|---|
| SMILES | CCCCCC(C)C(C)C1=CC2=C(C3=C(C(O2)(C)C)SCC3)C(=C1)OC(=O)CCCN4CCOCC4.Cl |
Product Overview
RefChem:294813 (CAS 50708-90-2), with molecular formula C30H46ClNO4S and molecular weight 551.28 g/mol. IUPAC: [4,4-dimethyl-7-(3-methyloctan-2-yl)-1,2-dihydrothieno[2,3-c]chromen-9-yl] 4-morpholin-4-ylbutanoate;hydrochloride.
Chemical Property Profile of RefChem:294813
Property Insights of RefChem:294813
The XLogP value of 7.4651 indicates that RefChem:294813 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, RefChem:294813 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:294813 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:294813?
The CAS number of RefChem:294813 is 50708-90-2.
What is the molecular formula of RefChem:294813?
The molecular formula of RefChem:294813 is C30H46ClNO4S.
What is the molecular weight of RefChem:294813?
The molecular weight of RefChem:294813 is 551.28 g/mol.
Where can I buy RefChem:294813?
You can request a quote for RefChem:294813 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:294813?
Yes, KEHONG BIO provides custom synthesis services for RefChem:294813 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.