TIBO
TL;DR: TIBO (CAS 126320-77-2) is a chemical compound with molecular formula C16H21N3S and molecular weight 287.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11S)-11-methyl-10-(3-methylbut-2-enyl)-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-triene-2-thione
Also Known As: TIBO, R 82150, R-82150, TIBO R82150, TIBO-R82150
| Molecular Formula | C16H21N3S |
|---|---|
| Molecular Weight | 287.15 g/mol |
| LogP | 3.86919 |
| Topological Polar Surface Area | 23.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.14563 |
| Heavy Atoms | 20 |
| Complexity | 718.88745 |
Chemical Identifiers
| CAS Number | 126320-77-2 |
|---|---|
| SMILES | C[C@H]1CN2C3=C(CN1CC=C(C)C)C=CC=C3NC2=S |
Product Overview
TIBO (CAS 126320-77-2), with molecular formula C16H21N3S and molecular weight 287.15 g/mol. IUPAC: (11S)-11-methyl-10-(3-methylbut-2-enyl)-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-triene-2-thione.
Chemical Property Profile of TIBO
Property Insights of TIBO
The XLogP value of 3.86919 indicates that TIBO is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.96 Ų, TIBO exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TIBO has 1 hydrogen bond donor(s) and 2 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 TIBO?
The CAS number of TIBO is 126320-77-2.
What is the molecular formula of TIBO?
The molecular formula of TIBO is C16H21N3S.
What is the molecular weight of TIBO?
The molecular weight of TIBO is 287.15 g/mol.
Where can I buy TIBO?
You can request a quote for TIBO directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TIBO?
Yes, KEHONG BIO provides custom synthesis services for TIBO and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.