N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine structure

N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine

TL;DR: N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine (CAS 84030-22-8) is a chemical compound with molecular formula C19H28N2O5S and molecular weight 396.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylsulfanylbutanoic acid

Also Known As: SulfadimethoxineSodiumSalt, N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine, 2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylsulfanylbutanoic acid, N-(N-((Phenylmethoxy)carbonyl)-L-isoleucyl)-L-methionine, 2-(2-{[(benzyloxy)carbonyl]amino}-3-methylpentanamido)-4-(methylsulfanyl)butanoic acid

CAS: 84030-22-8
Molecular Formula C19H28N2O5S
Molecular Weight 396.17 g/mol
LogP 3.1
Topological Polar Surface Area 130.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 6
Rotatable Bonds 12
Exact Mass 396.1719
Heavy Atoms 27
Complexity 483.0

Chemical Identifiers

CAS Number 84030-22-8
SMILES CCC(C)C(C(=O)NC(CCSC)C(=O)O)NC(=O)OCC1=CC=CC=C1
InChIKey GTXSTEDIVHHJQL-UHFFFAOYSA-N

Product Overview

N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine (CAS 84030-22-8), with molecular formula C19H28N2O5S and molecular weight 396.17 g/mol. IUPAC: 2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylsulfanylbutanoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine

XLogP
3.1
TPSA (Topological Polar Surface Area)
130.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
6
Rotatable Bonds
12
Heavy Atoms
27
Complexity
483.0
Exact Mass
396.1719
Monoisotopic Mass
396.1719
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-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine

The XLogP value of 3.1 indicates that N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine. Following Lipinski's Rule of Five, N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine has 3 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 typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine?

The CAS number of N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine is 84030-22-8.

What is the molecular formula of N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine?

The molecular formula of N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine is C19H28N2O5S.

What is the molecular weight of N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine?

The molecular weight of N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine is 396.17 g/mol.

Where can I buy N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine?

You can request a quote for N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine?

Yes, KEHONG BIO provides custom synthesis services for N-[N-[(phenylmethoxy)carbonyl]-L-isoleucyl]-L-methionine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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