RefChem:1089137
TL;DR: RefChem:1089137 (CAS 51490-40-5) is a chemical compound with molecular formula C22H29ClN2O and molecular weight 372.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-[(E)-[phenyl(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)methylidene]amino]oxyethanamine;hydrochloride
Also Known As: Methanone, phenyl(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)-, O-(2-(dimethylamino)ethyl)oxime, monohydrochloride, O-(2-Dimethylaminoethyl)-2-benzoyl-6,7,8,9-tetrahydro-5H-benzocycloheptenoxime hydrochloride, RefChem:1089137
| Molecular Formula | C22H29ClN2O |
|---|---|
| Molecular Weight | 372.20 g/mol |
| LogP | 4.7079 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.19684 |
| Heavy Atoms | 26 |
| Complexity | 713.3371 |
Chemical Identifiers
| CAS Number | 51490-40-5 |
|---|---|
| SMILES | CN(C)CCO/N=C(\C1=CC=CC=C1)/C2=CC3=C(CCCCC3)C=C2.Cl |
Product Overview
RefChem:1089137 (CAS 51490-40-5), with molecular formula C22H29ClN2O and molecular weight 372.20 g/mol. IUPAC: N,N-dimethyl-2-[(E)-[phenyl(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)methylidene]amino]oxyethanamine;hydrochloride.
Chemical Property Profile of RefChem:1089137
Property Insights of RefChem:1089137
The XLogP value of 4.7079 indicates that RefChem:1089137 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, RefChem:1089137 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1089137 has 0 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 RefChem:1089137?
The CAS number of RefChem:1089137 is 51490-40-5.
What is the molecular formula of RefChem:1089137?
The molecular formula of RefChem:1089137 is C22H29ClN2O.
What is the molecular weight of RefChem:1089137?
The molecular weight of RefChem:1089137 is 372.20 g/mol.
Where can I buy RefChem:1089137?
You can request a quote for RefChem:1089137 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1089137?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1089137 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.