2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-
TL;DR: 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- (CAS 19986-35-7) is a chemical compound with molecular formula C10H11ClN2O2 and molecular weight 226.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-[(dimethylamino)methyl]-1,3-benzoxazol-2-one
Also Known As: 5-Chloro-3-(dimethylaminomethyl)-2-benzoxazolinone, 2-BENZOXAZOLINONE, 5-CHLORO-3-((DIMETHYLAMINO)METHYL)-, 5-Chloro-3-[(dimethylamino)methyl]benzoxazol-2(3H)-one, 5-chloro-3-[(dimethylamino)methyl]-1,3-benzoxazol-2-one, 2-Benzoxazolinone, 5-chloro-3-[(dimethylamino)methyl]-
| Molecular Formula | C10H11ClN2O2 |
|---|---|
| Molecular Weight | 226.05 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.0509 |
| Heavy Atoms | 15 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 19986-35-7 |
|---|---|
| SMILES | CN(C)CN1C2=C(C=CC(=C2)Cl)OC1=O |
| InChIKey | DXPMJCLOFQOSSS-UHFFFAOYSA-N |
Product Overview
2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- (CAS 19986-35-7), with molecular formula C10H11ClN2O2 and molecular weight 226.05 g/mol. IUPAC: 5-chloro-3-[(dimethylamino)methyl]-1,3-benzoxazol-2-one.
Chemical Property Profile of 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-
Property Insights of 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-. With a topological polar surface area (TPSA) of 32.8 Ų, 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- 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 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-?
The CAS number of 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- is 19986-35-7.
What is the molecular formula of 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-?
The molecular formula of 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- is C10H11ClN2O2.
What is the molecular weight of 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-?
The molecular weight of 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- is 226.05 g/mol.
Where can I buy 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-?
You can request a quote for 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoxazolinone, 5-chloro-3-((dimethylamino)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.