3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide
TL;DR: 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide (CAS 1005635-98-2) is a chemical compound with molecular formula C14H14BrN5O2S and molecular weight 395.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide
Also Known As: 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide, 3-(4-bromo-1H-pyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)propanamide, 3-(4-BROMO-1H-PYRAZOL-1-YL)-N-[2,6-DIMETHYL-4-OXOTHIENO[2,3-D]PYRIMIDIN-3(4H)-YL]PROPANAMIDE
| Molecular Formula | C14H14BrN5O2S |
|---|---|
| Molecular Weight | 395.01 g/mol |
| LogP | 2.19424 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.00516 |
| Heavy Atoms | 23 |
| Complexity | 942.43555 |
Chemical Identifiers
| CAS Number | 1005635-98-2 |
|---|---|
| SMILES | CC1=CC2=C(S1)N=C(N(C2=O)NC(=O)CCN3C=C(C=N3)Br)C |
Product Overview
3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide (CAS 1005635-98-2), with molecular formula C14H14BrN5O2S and molecular weight 395.01 g/mol. IUPAC: 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide.
Chemical Property Profile of 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide
Property Insights of 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide
The XLogP value of 2.19424 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide. Following Lipinski's Rule of Five, 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide has 1 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-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide?
The CAS number of 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide is 1005635-98-2.
What is the molecular formula of 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide?
The molecular formula of 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide is C14H14BrN5O2S.
What is the molecular weight of 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide?
The molecular weight of 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide is 395.01 g/mol.
Where can I buy 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide?
You can request a quote for 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-bromopyrazol-1-yl)-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.