(E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 structure

(E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3

TL;DR: (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 (CAS 57616-57-6) is a chemical compound with molecular formula C25H25Cl2N3O5S and molecular weight 549.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

(E)-but-2-enedioic acid;4-[2-[[7-chloro-5-(2-chlorophenyl)-3H-1,4-benzodiazepin-2-yl]sulfanyl]ethyl]morpholine

Also Known As: (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3, (2E)-But-2-enedioic acid--7-chloro-5-(2-chlorophenyl)-2-{[2-(morpholin-4-yl)ethyl]sulfanyl}-3H-1,4-benzodiazepine (1/1), (E)-but-2-enedioic acid; 4-[2-[[7-chloro-5-(2-chlorophenyl)-3H-1,4-benzodiazepin-2-yl]sulfanyl]ethyl]morpholine, (E)-but-2-enedioic acid;4-[2-[[7-chloro-5-(2-chlorophenyl)-3H-1,4-benzodiazepin-2-yl]sulfanyl]ethyl]morpholine

CAS: 57616-57-6
Molecular Formula C25H25Cl2N3O5S
Molecular Weight 549.09 g/mol
LogP 4.6516
Topological Polar Surface Area 111.79 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 549.0892
Heavy Atoms 36
Complexity 1164.0347

Chemical Identifiers

CAS Number 57616-57-6
SMILES C1COCCN1CCSC2=NC3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4Cl.C(=C/C(=O)O)\C(=O)O

Product Overview

(E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 (CAS 57616-57-6), with molecular formula C25H25Cl2N3O5S and molecular weight 549.09 g/mol. IUPAC: (E)-but-2-enedioic acid;4-[2-[[7-chloro-5-(2-chlorophenyl)-3H-1,4-benzodiazepin-2-yl]sulfanyl]ethyl]morpholine.

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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 (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3

XLogP
4.6516
TPSA (Topological Polar Surface Area)
111.79
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
6
Heavy Atoms
36
Complexity
1164.0347
Exact Mass
549.0892
Monoisotopic Mass
549.0892
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 (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3

The XLogP value of 4.6516 indicates that (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.79 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3. Following Lipinski's Rule of Five, (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

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 (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3?

The CAS number of (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 is 57616-57-6.

What is the molecular formula of (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3?

The molecular formula of (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 is C25H25Cl2N3O5S.

What is the molecular weight of (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3?

The molecular weight of (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 is 549.09 g/mol.

Where can I buy (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3?

You can request a quote for (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3?

Yes, KEHONG BIO provides custom synthesis services for (E)-but-2-enedioic acid,4-[2-[[7-chloro-5-(2-chlorophenyl)-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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