RefChem:267701
TL;DR: RefChem:267701 (CAS 2521-13-3) is a chemical compound with molecular formula C14H29Cl2N2O2P and molecular weight 358.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-3-heptyl-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine
Also Known As: B 742, B-742, N,N-bis(2-chloroethyl)-3-heptyl-2-oxo-1,3,2, Tetrahydro-2-(bis(2-chloroethyl)amino)-3-heptyl-2H-1,3,2-oxazaphosphorine 2-oxide, 2H-1,3,2-Oxazaphosphorine, tetrahydro-2-(bis(2-chloroethyl)amino)-3-heptyl-, 2-oxide
| Molecular Formula | C14H29Cl2N2O2P |
|---|---|
| Molecular Weight | 358.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 358.13437 |
| Heavy Atoms | 21 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 2521-13-3 |
|---|---|
| SMILES | CCCCCCCN1CCCOP1(=O)N(CCCl)CCCl |
| InChIKey | WJYBLEUFTLTHSA-UHFFFAOYSA-N |
Product Overview
RefChem:267701 (CAS 2521-13-3), with molecular formula C14H29Cl2N2O2P and molecular weight 358.13 g/mol. IUPAC: N,N-bis(2-chloroethyl)-3-heptyl-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine.
Chemical Property Profile of RefChem:267701
Property Insights of RefChem:267701
The XLogP value of 4.1 indicates that RefChem:267701 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, RefChem:267701 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:267701 has 0 hydrogen bond donor(s) and 4 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 RefChem:267701?
The CAS number of RefChem:267701 is 2521-13-3.
What is the molecular formula of RefChem:267701?
The molecular formula of RefChem:267701 is C14H29Cl2N2O2P.
What is the molecular weight of RefChem:267701?
The molecular weight of RefChem:267701 is 358.13 g/mol.
Where can I buy RefChem:267701?
You can request a quote for RefChem:267701 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:267701?
Yes, KEHONG BIO provides custom synthesis services for RefChem:267701 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.