AE-848/13196114
TL;DR: AE-848/13196114 (CAS 372083-11-9) is a chemical compound with molecular formula C22H27N5O and molecular weight 377.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzylamino)-7-ethyl-3-morpholin-4-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
Also Known As: AE-848/13196114, 1-(benzylamino)-7-ethyl-3-morpholin-4-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile, 1-(benzylamino)-7-ethyl-3-morpholino-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile, 1-(benzylamino)-7-ethyl-3-(4-morpholinyl)-5,6,7,8-tetrahydro[2,7]naphthyridine-4-carbonitrile, 1-(benzylamino)-7-ethyl-3-(morpholin-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
| Molecular Formula | C22H27N5O |
|---|---|
| Molecular Weight | 377.22 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.22156 |
| Heavy Atoms | 28 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 372083-11-9 |
|---|---|
| SMILES | CCN1CCC2=C(C1)C(=NC(=C2C#N)N3CCOCC3)NCC4=CC=CC=C4 |
| InChIKey | PGNAXMOPNHGCQE-UHFFFAOYSA-N |
Product Overview
AE-848/13196114 (CAS 372083-11-9), with molecular formula C22H27N5O and molecular weight 377.22 g/mol. IUPAC: 1-(benzylamino)-7-ethyl-3-morpholin-4-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile.
Chemical Property Profile of AE-848/13196114
Property Insights of AE-848/13196114
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AE-848/13196114. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AE-848/13196114. Following Lipinski's Rule of Five, AE-848/13196114 has 1 hydrogen bond donor(s) and 6 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 AE-848/13196114?
The CAS number of AE-848/13196114 is 372083-11-9.
What is the molecular formula of AE-848/13196114?
The molecular formula of AE-848/13196114 is C22H27N5O.
What is the molecular weight of AE-848/13196114?
The molecular weight of AE-848/13196114 is 377.22 g/mol.
Where can I buy AE-848/13196114?
You can request a quote for AE-848/13196114 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-848/13196114?
Yes, KEHONG BIO provides custom synthesis services for AE-848/13196114 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.