2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-
TL;DR: 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- (CAS 3331-95-1) is a chemical compound with molecular formula C10H15Cl2NS and molecular weight 251.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-chloroethyl)-N-[(5-methylthiophen-2-yl)methyl]ethanamine
Also Known As: 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-, N,N-Bis(2-chloroethyl)-5-methyl-2-thenylamine, Bis(2-chloroethyl)-5-methyl-2-thenylamine, N,N-, N,N-Bis(2-chloroethyl)-5-methyl-2-thiophenemethanamine, 2-Thiophenemethanamine, N,N-bis(2-chloroethyl)-5-methyl-
| Molecular Formula | C10H15Cl2NS |
|---|---|
| Molecular Weight | 251.03 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 31.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 251.03023 |
| Heavy Atoms | 14 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 3331-95-1 |
|---|---|
| SMILES | CC1=CC=C(S1)CN(CCCl)CCCl |
| InChIKey | HZNSBTRDKVFVQI-UHFFFAOYSA-N |
Product Overview
2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- (CAS 3331-95-1), with molecular formula C10H15Cl2NS and molecular weight 251.03 g/mol. IUPAC: 2-chloro-N-(2-chloroethyl)-N-[(5-methylthiophen-2-yl)methyl]ethanamine.
Chemical Property Profile of 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-
Property Insights of 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-
The XLogP value of 3.1 indicates that 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.5 Ų, 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- has 0 hydrogen bond donor(s) and 2 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 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-?
The CAS number of 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- is 3331-95-1.
What is the molecular formula of 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-?
The molecular formula of 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- is C10H15Cl2NS.
What is the molecular weight of 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-?
The molecular weight of 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- is 251.03 g/mol.
Where can I buy 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-?
You can request a quote for 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Thenylamine, N,N-bis(2-chloroethyl)-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.