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Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- structure
Fine Chemical

Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-

TL;DR: Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- (CAS 112930-70-8) is a chemical compound with molecular formula C18H17NOS and molecular weight 295.1031 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(3E)-3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propanamide

Also Known As: Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-, (E)-3-(2-Methyl-6,11-dihydrodibenzo(b,e)thiepin-11-ylidene)propionamide, AE-641/30156005, 3-(2-methyldibenzo[b,e]thiepin-11(6H)-ylidene)propanamide, (3E)-3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propanamide

CAS Number
112930-70-8
Molecular Formula
C18H17NOS
Molecular Weight
295.1031 g/mol
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Technical Specifications

Molecular FormulaC18H17NOS
Molecular Weight295.1031 g/mol
XLogP3.4
Topological Polar Surface Area (TPSA)68.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass295.1031 Da
Heavy Atoms21
Complexity419.0
SMILESCC1=CC\2=C(C=C1)SCC3=CC=CC=C3/C2=C\CC(=O)N
InChIKeyUAKUOWLWHWAYSL-VIZOYTHASA-N

Chemical Property Profile of Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-

XLogP
3.4
TPSA (Topological Polar Surface Area)
68.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
21
Complexity
419.0
Exact Mass
295.1031
Monoisotopic Mass
295.1031
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 Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-

The XLogP value of 3.4 indicates that Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-. Following Lipinski's Rule of Five, Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-?

The CAS number of Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- is 112930-70-8.

What is the molecular formula of Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-?

The molecular formula of Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- is C18H17NOS.

What is the molecular weight of Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-?

The molecular weight of Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- is 295.1031 g/mol.

Where can I buy Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-?

You can request a quote for Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)-?

Yes, CoreyChem provides custom synthesis services for Propanamide, 3-(2-methyldibenzo(b,e)thiepin-11(6H)-ylidene)-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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