诺考达唑
TL;DR: 诺考达唑 (CAS 31430-18-9) is a chemical compound with molecular formula C14H11N3O3S and molecular weight 301.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
诺考达唑
methyl N-[6-(thiophene-2-carbonyl)-1H-benzimidazol-2-yl]carbamate
Also Known As: nocodazole, Oncodazole, Nocodazol, Nocodazolum, Nocidazole
| Molecular Formula | C14H11N3O3S |
|---|---|
| Molecular Weight | 301.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.05212 |
| Heavy Atoms | 21 |
| Complexity | 420.0 |
| Melting Point | 298.9 °C (decomposes) |
| Solubility | less than 1 mg/mL at 59 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 31430-18-9 |
|---|---|
| SMILES | COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CS3 |
| InChIKey | KYRVNWMVYQXFEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
诺考达唑 (CAS 31430-18-9), with molecular formula C14H11N3O3S and molecular weight 301.05 g/mol. IUPAC: methyl N-[6-(thiophene-2-carbonyl)-1H-benzimidazol-2-yl]carbamate.
Chemical Property Profile of 诺考达唑
Property Insights of 诺考达唑
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 诺考达唑. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 诺考达唑. Following Lipinski's Rule of Five, 诺考达唑 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 诺考达唑?
The CAS number of 诺考达唑 is 31430-18-9.
What is the molecular formula of 诺考达唑?
The molecular formula of 诺考达唑 is C14H11N3O3S.
What is the molecular weight of 诺考达唑?
The molecular weight of 诺考达唑 is 301.05 g/mol.
Where can I buy 诺考达唑?
You can request a quote for 诺考达唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 诺考达唑?
Yes, KEHONG BIO provides custom synthesis services for 诺考达唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.