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2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid structure
Fine Chemical

2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid

TL;DR: 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid (CAS 1005244-84-7) is a chemical compound with molecular formula C22H23NO5S and molecular weight 413.1297 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid

Also Known As: 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid, 3-{[3-(methoxycarbonyl)-4-(3-methylphenyl)thiophen-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid, 3-({[3-(methoxycarbonyl)-4-(3-methylphenyl)thien-2-yl]amino}carbonyl)bicyclo[2.2.1]heptane-2-carboxylic acid, 3-{N-[3-(methoxycarbonyl)-4-(3-methylphenyl)-2-thienyl]carbamoyl}bicyclo[2.2.1 ]heptane-2-carboxylic acid

CAS Number
1005244-84-7
Molecular Formula
C22H23NO5S
Molecular Weight
413.1297 g/mol
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Technical Specifications

Molecular FormulaC22H23NO5S
Molecular Weight413.1297 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)121.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds6
Exact Mass413.1297 Da
Heavy Atoms29
Complexity670.0
SMILESCC1=CC(=CC=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3C4CCC(C4)C3C(=O)O
InChIKeyNRWINUOHRGCJTO-UHFFFAOYSA-N

Chemical Property Profile of 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid

XLogP
4.7
TPSA (Topological Polar Surface Area)
121.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
6
Heavy Atoms
29
Complexity
670.0
Exact Mass
413.1297
Monoisotopic Mass
413.1297
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 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid

The XLogP value of 4.7 indicates that 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid. Following Lipinski's Rule of Five, 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid has 2 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 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?

The CAS number of 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid is 1005244-84-7.

What is the molecular formula of 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?

The molecular formula of 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid is C22H23NO5S.

What is the molecular weight of 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?

The molecular weight of 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid is 413.1297 g/mol.

Where can I buy 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?

You can request a quote for 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid?

Yes, CoreyChem provides custom synthesis services for 2-[[3-methoxycarbonyl-4-(3-methylphenyl)thiophen-2-yl]carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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