CGP-12177
TL;DR: CGP-12177 (CAS 81047-99-6) is a chemical compound with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
CGP-12177
4-[3-(tert-butylamino)-2-hydroxypropoxy]-1,3-dihydrobenzimidazol-2-one
Also Known As: Tbhpbo, Cgp 12177, Cgp 12177A, 1,4-Dibromo-2-butene, Spectrum4_000777
| Molecular Formula | C14H21N3O3 |
|---|---|
| Molecular Weight | 279.16 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.1583 |
| Heavy Atoms | 20 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 81047-99-6 |
|---|---|
| SMILES | CC(C)(C)NCC(COC1=CC=CC2=C1NC(=O)N2)O |
| InChIKey | UMQUQWCJKFOUGV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CGP-12177 (CAS 81047-99-6), with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol. IUPAC: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-1,3-dihydrobenzimidazol-2-one.
Chemical Property Profile of CGP-12177
Property Insights of CGP-12177
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CGP-12177. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for CGP-12177. Following Lipinski's Rule of Five, Tbhpbo has 4 hydrogen bond donor(s) and 4 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 Tbhpbo?
The CAS number of Tbhpbo is 81047-99-6.
What is the molecular formula of Tbhpbo?
The molecular formula of Tbhpbo is C14H21N3O3.
What is the molecular weight of Tbhpbo?
The molecular weight of Tbhpbo is 279.16 g/mol.
Where can I buy Tbhpbo?
You can request a quote for Tbhpbo directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tbhpbo?
Yes, KEHONG BIO provides custom synthesis services for Tbhpbo and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.