Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1)
TL;DR: Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) (CAS 75257-52-2) is a chemical compound with molecular formula C13H13Cl2N3O4S-2 and molecular weight 377.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-aminoethyl)-3-(2,6-dichlorophenyl)thiourea;(Z)-but-2-enedioate
Also Known As: Sid 733996, Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1), 1-(2-aminoethyl)-3-(2,6-dichlorophenyl)thiourea; (Z)-but-2-enedioate
| Molecular Formula | C13H13Cl2N3O4S-2 |
|---|---|
| Molecular Weight | 377.00 g/mol |
| LogP | -0.7191 |
| Topological Polar Surface Area | 130.34 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.0004 |
| Heavy Atoms | 23 |
| Complexity | 560.3324 |
Chemical Identifiers
| CAS Number | 75257-52-2 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)NC(=S)NCCN)Cl.C(=C\C(=O)[O-])\C(=O)[O-] |
Product Overview
Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) (CAS 75257-52-2), with molecular formula C13H13Cl2N3O4S-2 and molecular weight 377.00 g/mol. IUPAC: 1-(2-aminoethyl)-3-(2,6-dichlorophenyl)thiourea;(Z)-but-2-enedioate.
Chemical Property Profile of Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1)
Property Insights of Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1)
The XLogP value of -0.7191 indicates that Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1). Following Lipinski's Rule of Five, Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) 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
Frequently Asked Questions
What is the CAS number of Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1)?
The CAS number of Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) is 75257-52-2.
What is the molecular formula of Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1)?
The molecular formula of Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) is C13H13Cl2N3O4S-2.
What is the molecular weight of Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1)?
The molecular weight of Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) is 377.00 g/mol.
Where can I buy Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1)?
You can request a quote for Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1)?
Yes, KEHONG BIO provides custom synthesis services for Thiourea, N-(2-aminoethyl)-N'-(2,6-dichlorophenyl)-, (2Z)-2-butenedioate(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.