TimTec1_000381
TL;DR: TimTec1_000381 (CAS 331964-29-5) is a chemical compound with molecular formula C11H13N3S3 and molecular weight 283.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-ethyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dithione
Also Known As: TimTec1_000381, BAS 00700202, 7-ethyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dithione, 7-Ethyl-5,6,7,8-tetrahydro-1H-9-thia-1,3,7-triaza-fluorene-2,4-dithione, 7-ethyl-1,3,5,6,7,8-hexahydropyrimidino[5',4'-4,5]thiopheno[2,3-c]pyridine-2,4 -dithione
| Molecular Formula | C11H13N3S3 |
|---|---|
| Molecular Weight | 283.03 g/mol |
| LogP | 3.39448 |
| Topological Polar Surface Area | 34.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 283.02716 |
| Heavy Atoms | 17 |
| Complexity | 679.30695 |
Chemical Identifiers
| CAS Number | 331964-29-5 |
|---|---|
| SMILES | CCN1CCC2=C(C1)SC3=C2C(=S)NC(=S)N3 |
Product Overview
TimTec1_000381 (CAS 331964-29-5), with molecular formula C11H13N3S3 and molecular weight 283.03 g/mol. IUPAC: 11-ethyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dithione.
Chemical Property Profile of TimTec1_000381
Property Insights of TimTec1_000381
The XLogP value of 3.39448 indicates that TimTec1_000381 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.82 Ų, TimTec1_000381 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_000381 has 2 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 TimTec1_000381?
The CAS number of TimTec1_000381 is 331964-29-5.
What is the molecular formula of TimTec1_000381?
The molecular formula of TimTec1_000381 is C11H13N3S3.
What is the molecular weight of TimTec1_000381?
The molecular weight of TimTec1_000381 is 283.03 g/mol.
Where can I buy TimTec1_000381?
You can request a quote for TimTec1_000381 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_000381?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_000381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.