N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide
TL;DR: N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide (CAS 1005575-57-4) is a chemical compound with molecular formula C14H17N5O4S and molecular weight 351.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-1,3-dimethyl-4-nitropyrazole-5-carboxamide
Also Known As: N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide, N-(3-carbamoyl-5-propan-2-yl-thiophen-2-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide, N-[3-(AMINOCARBONYL)-5-ISOPROPYL-2-THIENYL]-1,3-DIMETHYL-4-NITRO-1H-PYRAZOLE-5-CARBOXAMIDE, N-[3-carbamoyl-5-(propan-2-yl)thiophen-2-yl]-1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide
| Molecular Formula | C14H17N5O4S |
|---|---|
| Molecular Weight | 351.10 g/mol |
| LogP | 2.17282 |
| Topological Polar Surface Area | 133.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.10013 |
| Heavy Atoms | 24 |
| Complexity | 836.5787 |
Chemical Identifiers
| CAS Number | 1005575-57-4 |
|---|---|
| SMILES | CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=C(S2)C(C)C)C(=O)N)C |
Product Overview
N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide (CAS 1005575-57-4), with molecular formula C14H17N5O4S and molecular weight 351.10 g/mol. IUPAC: N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-1,3-dimethyl-4-nitropyrazole-5-carboxamide.
Chemical Property Profile of N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide
Property Insights of N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide
The XLogP value of 2.17282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide. The TPSA of 133.15 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide has 2 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 N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide?
The CAS number of N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide is 1005575-57-4.
What is the molecular formula of N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide?
The molecular formula of N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide is C14H17N5O4S.
What is the molecular weight of N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide?
The molecular weight of N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide is 351.10 g/mol.
Where can I buy N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide?
You can request a quote for N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.