VU0498330-1
TL;DR: VU0498330-1 (CAS 899952-50-2) is a chemical compound with molecular formula C14H22N4O3S and molecular weight 326.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-N-(3-hydroxypropyl)oxamide
Also Known As: VU0498330-1, F2780-0696, N'-{2-tert-butyl-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl}-N-(3-hydroxypropyl)ethanediamide, N'-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-N-(3-hydroxypropyl)oxamide, N1-(2-(tert-butyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-N2-(3-hydroxypropyl)oxalamide
| Molecular Formula | C14H22N4O3S |
|---|---|
| Molecular Weight | 326.14 g/mol |
| LogP | 0.822 |
| Topological Polar Surface Area | 96.25 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.14127 |
| Heavy Atoms | 22 |
| Complexity | 577.3785 |
Chemical Identifiers
| CAS Number | 899952-50-2 |
|---|---|
| SMILES | CC(C)(C)N1C(=C2CSCC2=N1)NC(=O)C(=O)NCCCO |
Product Overview
VU0498330-1 (CAS 899952-50-2), with molecular formula C14H22N4O3S and molecular weight 326.14 g/mol. IUPAC: N'-(2-tert-butyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-N-(3-hydroxypropyl)oxamide.
Chemical Property Profile of VU0498330-1
Property Insights of VU0498330-1
The XLogP value of 0.822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0498330-1. The TPSA of 96.25 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0498330-1. Following Lipinski's Rule of Five, VU0498330-1 has 3 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 VU0498330-1?
The CAS number of VU0498330-1 is 899952-50-2.
What is the molecular formula of VU0498330-1?
The molecular formula of VU0498330-1 is C14H22N4O3S.
What is the molecular weight of VU0498330-1?
The molecular weight of VU0498330-1 is 326.14 g/mol.
Where can I buy VU0498330-1?
You can request a quote for VU0498330-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0498330-1?
Yes, KEHONG BIO provides custom synthesis services for VU0498330-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.