![[(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea structure](/static/products/921/92106-17-7.png)
[(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea
TL;DR: [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea (CAS 92106-17-7) is a chemical compound with molecular formula C13H18Cl2N4S and molecular weight 332.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea
Also Known As: [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea|(2E)-2-({4-[Bis(2-chloroethyl)amino]-2-methylphenyl}methylidene)hydrazine-1-carbothioamide
| Molecular Formula | C13H18Cl2N4S |
|---|---|
| Molecular Weight | 332.06 g/mol |
| LogP | 2.44612 |
| Topological Polar Surface Area | 53.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 332.06293 |
| Heavy Atoms | 20 |
| Complexity | 473.439 |
Chemical Identifiers
| CAS Number | 92106-17-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCCl)CCCl)/C=N/NC(=S)N |
Product Overview
[(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea (CAS 92106-17-7), with molecular formula C13H18Cl2N4S and molecular weight 332.06 g/mol. IUPAC: [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea.
Chemical Property Profile of [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea
Property Insights of [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea
The XLogP value of 2.44612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea. With a topological polar surface area (TPSA) of 53.65 Ų, [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea has 2 hydrogen bond donor(s) and 3 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 [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea?
The CAS number of [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea is 92106-17-7.
What is the molecular formula of [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea?
The molecular formula of [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea is C13H18Cl2N4S.
What is the molecular weight of [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea?
The molecular weight of [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea is 332.06 g/mol.
Where can I buy [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea?
You can request a quote for [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(E)-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.