TimTec1_001135
TL;DR: TimTec1_001135 (CAS 312949-38-5) is a chemical compound with molecular formula C20H24N2O2S and molecular weight 356.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-[(4-methylbenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: TimTec1_001135, BRD-K86119345-001-01-2, A2028/0085174, N,N-dimethyl-2-[(4-methylbenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, N,N-DIMETHYL-2-(4-METHYLBENZAMIDO)-4H,5H,6H,7H,8H-CYCLOHEPTA[B]THIOPHENE-3-CARBOXAMIDE
| Molecular Formula | C20H24N2O2S |
|---|---|
| Molecular Weight | 356.16 g/mol |
| LogP | 4.27952 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.15585 |
| Heavy Atoms | 25 |
| Complexity | 790.77264 |
Chemical Identifiers
| CAS Number | 312949-38-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N(C)C |
Product Overview
TimTec1_001135 (CAS 312949-38-5), with molecular formula C20H24N2O2S and molecular weight 356.16 g/mol. IUPAC: N,N-dimethyl-2-[(4-methylbenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
Chemical Property Profile of TimTec1_001135
Property Insights of TimTec1_001135
The XLogP value of 4.27952 indicates that TimTec1_001135 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, TimTec1_001135 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_001135 has 1 hydrogen bond donor(s) and 3 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_001135?
The CAS number of TimTec1_001135 is 312949-38-5.
What is the molecular formula of TimTec1_001135?
The molecular formula of TimTec1_001135 is C20H24N2O2S.
What is the molecular weight of TimTec1_001135?
The molecular weight of TimTec1_001135 is 356.16 g/mol.
Where can I buy TimTec1_001135?
You can request a quote for TimTec1_001135 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_001135?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_001135 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.