1,3,5-苯三胺N,N-双(2-氯乙基)衍生物
TL;DR: 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 (CAS 58200-03-6) is a chemical compound with molecular formula C10H15Cl2N3 and molecular weight 247.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-苯三胺N,N-双(2-氯乙基)衍生物
3-N,3-N-bis(2-chloroethyl)benzene-1,3,5-triamine
Also Known As: N(CCCl)(CCCl)c1cc(N)cc(N)c1, 1,3,5-Benzenetriamine, N,N-bis(2-chloroethyl)-, N,N-Bis(2-chloroethyl)-1,3,5-benzenetriamine, N1,N1-Bis(2-chloroethyl)-1,3,5-benzenetriamine, N1,N1-bis(2-chloroethyl)benzene-1,3,5-triamine
| Molecular Formula | C10H15Cl2N3 |
|---|---|
| Molecular Weight | 247.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 55.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.0643 |
| Heavy Atoms | 15 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 58200-03-6 |
|---|---|
| SMILES | C1=C(C=C(C=C1N)N(CCCl)CCCl)N |
| InChIKey | CIKSOOFSBWWVOQ-UHFFFAOYSA-N |
Product Overview
1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 (CAS 58200-03-6), with molecular formula C10H15Cl2N3 and molecular weight 247.06 g/mol. IUPAC: 3-N,3-N-bis(2-chloroethyl)benzene-1,3,5-triamine.
Chemical Property Profile of 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物
Property Insights of 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物. With a topological polar surface area (TPSA) of 55.3 Ų, 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 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 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物?
The CAS number of 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 is 58200-03-6.
What is the molecular formula of 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物?
The molecular formula of 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 is C10H15Cl2N3.
What is the molecular weight of 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物?
The molecular weight of 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 is 247.06 g/mol.
Where can I buy 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物?
You can request a quote for 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-苯三胺N,N-双(2-氯乙基)衍生物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.