CBKinase1_007593
TL;DR: CBKinase1_007593 (CAS 511282-85-2) is a chemical compound with molecular formula C12H13N5O2S2 and molecular weight 323.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Also Known As: CBKinase1_007593, CBKinase1_019993, VU0618409-1, F3394-1181, BRD-K81803788-001-01-0
| Molecular Formula | C12H13N5O2S2 |
|---|---|
| Molecular Weight | 323.05 g/mol |
| LogP | 1.1846 |
| Topological Polar Surface Area | 113.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.05106 |
| Heavy Atoms | 21 |
| Complexity | 680.1342 |
Chemical Identifiers
| CAS Number | 511282-85-2 |
|---|---|
| SMILES | C1CC2=C(C1)SC(=C2C(=O)N)NC(=O)CSC3=NC=NN3 |
Product Overview
CBKinase1_007593 (CAS 511282-85-2), with molecular formula C12H13N5O2S2 and molecular weight 323.05 g/mol. IUPAC: 2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide.
Chemical Property Profile of CBKinase1_007593
Property Insights of CBKinase1_007593
The XLogP value of 1.1846 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_007593. The TPSA of 113.76 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007593. Following Lipinski's Rule of Five, CBKinase1_007593 has 3 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 CBKinase1_007593?
The CAS number of CBKinase1_007593 is 511282-85-2.
What is the molecular formula of CBKinase1_007593?
The molecular formula of CBKinase1_007593 is C12H13N5O2S2.
What is the molecular weight of CBKinase1_007593?
The molecular weight of CBKinase1_007593 is 323.05 g/mol.
Where can I buy CBKinase1_007593?
You can request a quote for CBKinase1_007593 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007593?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007593 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.