RefChem:332151
TL;DR: RefChem:332151 (CAS 105774-17-2) is a chemical compound with molecular formula C20H24ClN3O3 and molecular weight 389.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[11-[2-(dimethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride
Also Known As: Carbamic acid, (5-((dimethylamino)acetyl)-10,11-dihydro-5H-dibenz(b,f)azepin-3-yl)-, methyl ester, monohydrochloride, methyl (5-(2-(dimethylamino)acetyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)carbamate hydrochloride, methyl N-[11-[2-(dimethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride, Methyl [5-(N,N-dimethylglycyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate--hydrogen chloride (1/1), methyl N-[11-[2-(dimethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
| Molecular Formula | C20H24ClN3O3 |
|---|---|
| Molecular Weight | 389.15 g/mol |
| LogP | 3.6116 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.1506 |
| Heavy Atoms | 27 |
| Complexity | 838.9717 |
Chemical Identifiers
| CAS Number | 105774-17-2 |
|---|---|
| SMILES | CN(C)CC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OC.Cl |
Product Overview
RefChem:332151 (CAS 105774-17-2), with molecular formula C20H24ClN3O3 and molecular weight 389.15 g/mol. IUPAC: methyl N-[11-[2-(dimethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate;hydrochloride.
Chemical Property Profile of RefChem:332151
Property Insights of RefChem:332151
The XLogP value of 3.6116 indicates that RefChem:332151 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:332151. Following Lipinski's Rule of Five, RefChem:332151 has 1 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:332151?
The CAS number of RefChem:332151 is 105774-17-2.
What is the molecular formula of RefChem:332151?
The molecular formula of RefChem:332151 is C20H24ClN3O3.
What is the molecular weight of RefChem:332151?
The molecular weight of RefChem:332151 is 389.15 g/mol.
Where can I buy RefChem:332151?
You can request a quote for RefChem:332151 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:332151?
Yes, KEHONG BIO provides custom synthesis services for RefChem:332151 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.