5-Amino-3-isopropylisothiazole-4-carboxamide
TL;DR: 5-Amino-3-isopropylisothiazole-4-carboxamide (CAS 41808-42-8) is a chemical compound with molecular formula C7H11N3OS and molecular weight 185.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-3-propan-2-yl-1,2-thiazole-4-carboxamide
Also Known As: 5-AMINO-3-ISOPROPYLISOTHIAZOLE-4-CARBOXAMIDE, 4-Isothiazolecarboxamide, 5-amino-3-(1-methylethyl)-, 5-Amino-3-isopropylisothiazol-4-carboxamid, 5-amino-3-isopropyl-isothiazole-4-carboxamide, 5-amino-3-propan-2-yl-1,2-thiazole-4-carboxamide
| Molecular Formula | C7H11N3OS |
|---|---|
| Molecular Weight | 185.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.06229 |
| Heavy Atoms | 12 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 41808-42-8 |
|---|---|
| SMILES | CC(C)C1=NSC(=C1C(=O)N)N |
| InChIKey | XHGVDHOYORGAQN-UHFFFAOYSA-N |
Product Overview
5-Amino-3-isopropylisothiazole-4-carboxamide (CAS 41808-42-8), with molecular formula C7H11N3OS and molecular weight 185.06 g/mol. IUPAC: 5-amino-3-propan-2-yl-1,2-thiazole-4-carboxamide.
Chemical Property Profile of 5-Amino-3-isopropylisothiazole-4-carboxamide
Property Insights of 5-Amino-3-isopropylisothiazole-4-carboxamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-3-isopropylisothiazole-4-carboxamide. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-3-isopropylisothiazole-4-carboxamide. Following Lipinski's Rule of Five, 5-Amino-3-isopropylisothiazole-4-carboxamide has 2 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 5-Amino-3-isopropylisothiazole-4-carboxamide?
The CAS number of 5-Amino-3-isopropylisothiazole-4-carboxamide is 41808-42-8.
What is the molecular formula of 5-Amino-3-isopropylisothiazole-4-carboxamide?
The molecular formula of 5-Amino-3-isopropylisothiazole-4-carboxamide is C7H11N3OS.
What is the molecular weight of 5-Amino-3-isopropylisothiazole-4-carboxamide?
The molecular weight of 5-Amino-3-isopropylisothiazole-4-carboxamide is 185.06 g/mol.
Where can I buy 5-Amino-3-isopropylisothiazole-4-carboxamide?
You can request a quote for 5-Amino-3-isopropylisothiazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-3-isopropylisothiazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-3-isopropylisothiazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.