Saptomycin B
TL;DR: Saptomycin B (CAS 114798-35-5) is a chemical compound with molecular formula C21H19ClN6O and molecular weight 406.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carbaldehyde
Also Known As: Saptomycin B, Exp 3312, 5-chloro-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carbaldehyde, 1H-Imidazole-5-carboxaldehyde, 4-chloro-2-propyl-1-((2'-(1H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-, 2-n-Propyl-4-chloro-1-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)imidazole-5-carboxylaldehyde
| Molecular Formula | C21H19ClN6O |
|---|---|
| Molecular Weight | 406.13 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 89.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 406.1309 |
| Heavy Atoms | 29 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 114798-35-5 |
|---|---|
| SMILES | CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)C=O)Cl |
| InChIKey | IMVDZFOSXJSXFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Saptomycin B (CAS 114798-35-5), with molecular formula C21H19ClN6O and molecular weight 406.13 g/mol. IUPAC: 5-chloro-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carbaldehyde.
Chemical Property Profile of Saptomycin B
Property Insights of Saptomycin B
The XLogP value of 4.4 indicates that Saptomycin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Saptomycin B. Following Lipinski's Rule of Five, Saptomycin B 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 Saptomycin B?
The CAS number of Saptomycin B is 114798-35-5.
What is the molecular formula of Saptomycin B?
The molecular formula of Saptomycin B is C21H19ClN6O.
What is the molecular weight of Saptomycin B?
The molecular weight of Saptomycin B is 406.13 g/mol.
Where can I buy Saptomycin B?
You can request a quote for Saptomycin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Saptomycin B?
Yes, KEHONG BIO provides custom synthesis services for Saptomycin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.