A3715/0157356
TL;DR: A3715/0157356 (CAS 714279-29-5) is a chemical compound with molecular formula C18H23N7O5 and molecular weight 417.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-5-[4-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]piperazin-1-yl]-6-nitrobenzimidazol-2-one
Also Known As: A3715/0157356, 1,3-dimethyl-5-[4-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]piperazin-1-yl]-6-nitrobenzimidazol-2-one, 1,3-dimethyl-5-(4-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}piperazin-1-yl)-6-nitro-1,3-dihydro-2H-benzimidazol-2-one, 1,3-DIMETHYL-5-(4-{2-[(4-METHYL-1,2,5-OXADIAZOL-3-YL)OXY]ETHYL}PIPERAZIN-1-YL)-6-NITRO-2,3-DIHYDRO-1H-1,3-BENZODIAZOL-2-ONE
| Molecular Formula | C18H23N7O5 |
|---|---|
| Molecular Weight | 417.18 g/mol |
| LogP | 0.67762 |
| Topological Polar Surface Area | 124.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.17606 |
| Heavy Atoms | 30 |
| Complexity | 1139.9429 |
Chemical Identifiers
| CAS Number | 714279-29-5 |
|---|---|
| SMILES | CC1=NON=C1OCCN2CCN(CC2)C3=C(C=C4C(=C3)N(C(=O)N4C)C)[N+](=O)[O-] |
Product Overview
A3715/0157356 (CAS 714279-29-5), with molecular formula C18H23N7O5 and molecular weight 417.18 g/mol. IUPAC: 1,3-dimethyl-5-[4-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]piperazin-1-yl]-6-nitrobenzimidazol-2-one.
Chemical Property Profile of A3715/0157356
Property Insights of A3715/0157356
The XLogP value of 0.67762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3715/0157356. The TPSA of 124.7 Ų falls within the moderate polarity range, balancing permeability and solubility for A3715/0157356. Following Lipinski's Rule of Five, A3715/0157356 has 0 hydrogen bond donor(s) and 9 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 A3715/0157356?
The CAS number of A3715/0157356 is 714279-29-5.
What is the molecular formula of A3715/0157356?
The molecular formula of A3715/0157356 is C18H23N7O5.
What is the molecular weight of A3715/0157356?
The molecular weight of A3715/0157356 is 417.18 g/mol.
Where can I buy A3715/0157356?
You can request a quote for A3715/0157356 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3715/0157356?
Yes, KEHONG BIO provides custom synthesis services for A3715/0157356 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.