RefChem:1054675
TL;DR: RefChem:1054675 (CAS 15856-40-3) is a chemical compound with molecular formula C12H19ClN2O2 and molecular weight 258.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethylamino)propan-2-yl N-phenylcarbamate;hydrochloride
Also Known As: O-(1-(N,N-Dimethylamino)propyl-2)-N-phenylurethane hydrochloride, 2-Propanol, 1-(dimethylamino)-, carbanilate (ester), monohydrochloride, O-(1-(N,N-Dimetilamino)propil-2)-N-feniluretan hidroklorida, O-(1-(N,N-Dimetilamino)propil-2)-N-feniluretan hidroklorida [Yugoslavian], 1-(dimethylamino)propan-2-yl N-phenylcarbamate hydrochloride
| Molecular Formula | C12H19ClN2O2 |
|---|---|
| Molecular Weight | 258.11 g/mol |
| LogP | 2.607 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.1135 |
| Heavy Atoms | 17 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 15856-40-3 |
|---|---|
| SMILES | CC(CN(C)C)OC(=O)NC1=CC=CC=C1.Cl |
| InChIKey | XXPPTLFBERWMLP-UHFFFAOYSA-N |
Product Overview
RefChem:1054675 (CAS 15856-40-3), with molecular formula C12H19ClN2O2 and molecular weight 258.11 g/mol. IUPAC: 1-(dimethylamino)propan-2-yl N-phenylcarbamate;hydrochloride.
Chemical Property Profile of RefChem:1054675
Property Insights of RefChem:1054675
The XLogP value of 2.607 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1054675. With a topological polar surface area (TPSA) of 41.6 Ų, RefChem:1054675 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1054675 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 RefChem:1054675?
The CAS number of RefChem:1054675 is 15856-40-3.
What is the molecular formula of RefChem:1054675?
The molecular formula of RefChem:1054675 is C12H19ClN2O2.
What is the molecular weight of RefChem:1054675?
The molecular weight of RefChem:1054675 is 258.11 g/mol.
Where can I buy RefChem:1054675?
You can request a quote for RefChem:1054675 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1054675?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1054675 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.