methanone structure](/static/products/3390/339019-99-7.webp)
[2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone
TL;DR: [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone (CAS 339019-99-7) is a chemical compound with molecular formula C13H12FN3OS and molecular weight 277.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-amino-2-(prop-2-enylamino)-1,3-thiazol-5-yl]-(4-fluorophenyl)methanone
Also Known As: [2-(allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone, 5-(4-fluorobenzoyl)-N2-(prop-2-en-1-yl)-1,3-thiazole-2,4-diamine, BAS 07417557, 7N-719, [4-amino-2-(prop-2-enylamino)-1,3-thiazol-5-yl]-(4-fluorophenyl)methanone
| Molecular Formula | C13H12FN3OS |
|---|---|
| Molecular Weight | 277.07 g/mol |
| LogP | 2.6933 |
| Topological Polar Surface Area | 68.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 277.0685 |
| Heavy Atoms | 19 |
| Complexity | 606.85095 |
Chemical Identifiers
| CAS Number | 339019-99-7 |
|---|---|
| SMILES | C=CCNC1=NC(=C(S1)C(=O)C2=CC=C(C=C2)F)N |
Product Overview
[2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone (CAS 339019-99-7), with molecular formula C13H12FN3OS and molecular weight 277.07 g/mol. IUPAC: [4-amino-2-(prop-2-enylamino)-1,3-thiazol-5-yl]-(4-fluorophenyl)methanone.
Chemical Property Profile of [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone
Property Insights of [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone
The XLogP value of 2.6933 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone. The TPSA of 68.01 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone. Following Lipinski's Rule of Five, [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone has 2 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 [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone?
The CAS number of [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone is 339019-99-7.
What is the molecular formula of [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone?
The molecular formula of [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone is C13H12FN3OS.
What is the molecular weight of [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone?
The molecular weight of [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone is 277.07 g/mol.
Where can I buy [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone?
You can request a quote for [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [2-(Allylamino)-4-amino-1,3-thiazol-5-yl](4-fluorophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.