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N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine structure
Fine Chemical

N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine

TL;DR: N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine (CAS 1173662-63-9) is a chemical compound with molecular formula C17H20FN3O4 and molecular weight 349.1438 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[[(2S)-2-[(5-fluoro-1-methylindole-2-carbonyl)amino]-3-methylbutanoyl]amino]acetic acid

Also Known As: N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine, (S)-2-(2-(5-fluoro-1-methyl-1H-indole-2-carboxamido)-3-methylbutanamido)acetic acid, 2-[[2-[(5-fluoro-1-methyl-indole-2-carbonyl)amino]-3-methyl-butanoyl]amino]acetic Acid

CAS Number
1173662-63-9
Molecular Formula
C17H20FN3O4
Molecular Weight
349.1438 g/mol
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Technical Specifications

Molecular FormulaC17H20FN3O4
Molecular Weight349.1438 g/mol
XLogP2.0
Topological Polar Surface Area (TPSA)100.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass349.1438 Da
Heavy Atoms25
Complexity528.0
SMILESCC(C)[C@@H](C(=O)NCC(=O)O)NC(=O)C1=CC2=C(N1C)C=CC(=C2)F
InChIKeyUCQRWFOICCBZFE-HNNXBMFYSA-N

Chemical Property Profile of N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine

XLogP
2.0
TPSA (Topological Polar Surface Area)
100.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
25
Complexity
528.0
Exact Mass
349.1438
Monoisotopic Mass
349.1438
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 N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine

The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine. Following Lipinski's Rule of Five, N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine?

The CAS number of N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine is 1173662-63-9.

What is the molecular formula of N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine?

The molecular formula of N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine is C17H20FN3O4.

What is the molecular weight of N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine?

The molecular weight of N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine is 349.1438 g/mol.

Where can I buy N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine?

You can request a quote for N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine?

Yes, CoreyChem provides custom synthesis services for N-[(5-fluoro-1-methyl-1H-indol-2-yl)carbonyl]-L-valylglycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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