![1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea structure](/static/products/694/6942-49-0.png)
1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea
TL;DR: 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea (CAS 6942-49-0) is a chemical compound with molecular formula C20H31Cl2N3S and molecular weight 415.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea
Also Known As: (2E)-2-[(3,4-Dichlorophenyl)methylidene]-N-dodecylhydrazine-1-carbothioamide
| Molecular Formula | C20H31Cl2N3S |
|---|---|
| Molecular Weight | 415.16 g/mol |
| LogP | 6.7123 |
| Topological Polar Surface Area | 36.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 13 |
| Exact Mass | 415.16156 |
| Heavy Atoms | 26 |
| Complexity | 549.85785 |
Chemical Identifiers
| CAS Number | 6942-49-0 |
|---|---|
| SMILES | CCCCCCCCCCCCNC(=S)N/N=C/C1=CC(=C(C=C1)Cl)Cl |
Product Overview
1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea (CAS 6942-49-0), with molecular formula C20H31Cl2N3S and molecular weight 415.16 g/mol. IUPAC: 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea.
Chemical Property Profile of 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea
Property Insights of 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea
The XLogP value of 6.7123 indicates that 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.42 Ų, 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea?
The CAS number of 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea is 6942-49-0.
What is the molecular formula of 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea?
The molecular formula of 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea is C20H31Cl2N3S.
What is the molecular weight of 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea?
The molecular weight of 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea is 415.16 g/mol.
Where can I buy 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea?
You can request a quote for 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(E)-(3,4-dichlorophenyl)methylideneamino]-3-dodecylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.