![3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one structure](/static/products/117/1173685-95-4.png)
3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
TL;DR: 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one (CAS 1173685-95-4) is a chemical compound with molecular formula C16H20N4O3 and molecular weight 316.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2S)-3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one
Also Known As: 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one, (S)-3-(3-methyl-1-morpholino-1-oxobutan-2-yl)benzo[d][1,2,3]triazin-4(3H)-one
| Molecular Formula | C16H20N4O3 |
|---|---|
| Molecular Weight | 316.15 g/mol |
| LogP | 0.8474 |
| Topological Polar Surface Area | 77.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.15353 |
| Heavy Atoms | 23 |
| Complexity | 765.2546 |
Chemical Identifiers
| CAS Number | 1173685-95-4 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)N1CCOCC1)N2C(=O)C3=CC=CC=C3N=N2 |
Product Overview
3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one (CAS 1173685-95-4), with molecular formula C16H20N4O3 and molecular weight 316.15 g/mol. IUPAC: 3-[(2S)-3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl]-1,2,3-benzotriazin-4-one.
Chemical Property Profile of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Property Insights of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
The XLogP value of 0.8474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one. The TPSA of 77.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one. Following Lipinski's Rule of Five, 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one has 0 hydrogen bond donor(s) and 5 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 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one?
The CAS number of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one is 1173685-95-4.
What is the molecular formula of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one?
The molecular formula of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one is C16H20N4O3.
What is the molecular weight of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one?
The molecular weight of 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one is 316.15 g/mol.
Where can I buy 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one?
You can request a quote for 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2S)-3-methyl-1-(morpholin-4-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.