A3866/0164217
TL;DR: A3866/0164217 (CAS 1030839-36-1) is a chemical compound with molecular formula C27H32N2O3 and molecular weight 432.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[1-(2-adamantylamino)-1-oxo-3-phenylpropan-2-yl]carbamate
Also Known As: A3866/0164217, benzyl [2-(2-adamantylamino)-1-benzyl-2-oxoethyl]carbamate, benzyl [1-oxo-3-phenyl-1-(tricyclo[3.3.1.1~3,7~]dec-2-ylamino)propan-2-yl]carbamate, benzyl N-[1-(2-adamantylamino)-1-oxo-3-phenylpropan-2-yl]carbamate, benzyl (1-(adamantan-2-ylamino)-1-oxo-3-phenylpropan-2-yl)carbamate
| Molecular Formula | C27H32N2O3 |
|---|---|
| Molecular Weight | 432.24 g/mol |
| LogP | 4.465 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.2413 |
| Heavy Atoms | 32 |
| Complexity | 902.4324 |
Chemical Identifiers
| CAS Number | 1030839-36-1 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)C3NC(=O)C(CC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5 |
Product Overview
A3866/0164217 (CAS 1030839-36-1), with molecular formula C27H32N2O3 and molecular weight 432.24 g/mol. IUPAC: benzyl N-[1-(2-adamantylamino)-1-oxo-3-phenylpropan-2-yl]carbamate.
Chemical Property Profile of A3866/0164217
Property Insights of A3866/0164217
The XLogP value of 4.465 indicates that A3866/0164217 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for A3866/0164217. Following Lipinski's Rule of Five, A3866/0164217 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 A3866/0164217?
The CAS number of A3866/0164217 is 1030839-36-1.
What is the molecular formula of A3866/0164217?
The molecular formula of A3866/0164217 is C27H32N2O3.
What is the molecular weight of A3866/0164217?
The molecular weight of A3866/0164217 is 432.24 g/mol.
Where can I buy A3866/0164217?
You can request a quote for A3866/0164217 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3866/0164217?
Yes, KEHONG BIO provides custom synthesis services for A3866/0164217 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.