methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate structure

methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate

TL;DR: methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate (CAS 1020114-07-1) is a chemical compound with molecular formula C17H21N3O4 and molecular weight 331.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

methyl (2S)-4-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]pentanoate

Also Known As: methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate, (S)-methyl 4-methyl-2-(2-(4-oxoquinazolin-3(4H)-yl)acetamido)pentanoate, methyl (2S)-4-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]pentanoate

CAS: 1020114-07-1
Molecular Formula C17H21N3O4
Molecular Weight 331.15 g/mol
LogP 1.1004
Topological Polar Surface Area 90.29 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 331.1532
Heavy Atoms 24
Complexity 797.7674

Chemical Identifiers

CAS Number 1020114-07-1
SMILES CC(C)C[C@@H](C(=O)OC)NC(=O)CN1C=NC2=CC=CC=C2C1=O

Product Overview

methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate (CAS 1020114-07-1), with molecular formula C17H21N3O4 and molecular weight 331.15 g/mol. IUPAC: methyl (2S)-4-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]pentanoate.

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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 methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate

XLogP
1.1004
TPSA (Topological Polar Surface Area)
90.29
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
24
Complexity
797.7674
Exact Mass
331.1532
Monoisotopic Mass
331.1532
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 methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate

The XLogP value of 1.1004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate. The TPSA of 90.29 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate. Following Lipinski's Rule of Five, methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate has 1 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 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 methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate?

The CAS number of methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate is 1020114-07-1.

What is the molecular formula of methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate?

The molecular formula of methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate is C17H21N3O4.

What is the molecular weight of methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate?

The molecular weight of methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate is 331.15 g/mol.

Where can I buy methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate?

You can request a quote for methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate?

Yes, KEHONG BIO provides custom synthesis services for methyl N-[(4-oxoquinazolin-3(4H)-yl)acetyl]-L-leucinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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