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EINECS 244-306-4 structure
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EINECS 244-306-4

TL;DR: EINECS 244-306-4 (CAS 21269-13-6) is a chemical compound with molecular formula C25H33NO5 and molecular weight 427.23587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[2-oxo-2-(6,9,13-trimethyl-16-oxo-5-oxa-7-azapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,17-dien-8-yl)ethyl] acetate

Also Known As: 2-oxo-2-(4a,6a,8-trimethyl-2-oxo-2,3,4,4a,4b,5,6,6a,9a,10,10a,10b,11,12-tetradecahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]oxazol-6b-yl)ethyl acetate

CAS Number
21269-13-6
Molecular Formula
C25H33NO5
Molecular Weight
427.23587 g/mol
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Technical Specifications

Molecular FormulaC25H33NO5
Molecular Weight427.23587 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)82.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass427.23587 Da
Heavy Atoms31
Complexity921.0
SMILESCC1=NC2(C(O1)CC3C2(CCC4C3CCC5=CC(=O)CCC45C)C)C(=O)COC(=O)C
InChIKeyVVMRUTPNARVFIR-UHFFFAOYSA-N

Chemical Property Profile of EINECS 244-306-4

XLogP
2.9
TPSA (Topological Polar Surface Area)
82.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
31
Complexity
921.0
Exact Mass
427.23587
Monoisotopic Mass
427.23587
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of EINECS 244-306-4

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 244-306-4. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 244-306-4. Following Lipinski's Rule of Five, EINECS 244-306-4 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of EINECS 244-306-4?

The CAS number of EINECS 244-306-4 is 21269-13-6.

What is the molecular formula of EINECS 244-306-4?

The molecular formula of EINECS 244-306-4 is C25H33NO5.

What is the molecular weight of EINECS 244-306-4?

The molecular weight of EINECS 244-306-4 is 427.23587 g/mol.

Where can I buy EINECS 244-306-4?

You can request a quote for EINECS 244-306-4 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for EINECS 244-306-4?

Yes, CoreyChem provides custom synthesis services for EINECS 244-306-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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