A2222/0093581
TL;DR: A2222/0093581 (CAS 312949-85-2) 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,6-trimethyl-2-[(4-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: A2222/0093581, N,N,6-trimethyl-2-[(4-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N,N,6-trimethyl-2-{[(4-methylphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N,N,6-TRIMETHYL-2-(4-METHYLBENZAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE, N,N-dimethyl{6-methyl-2-[(4-methylphenyl)carbonylamino](4,5,6,7-tetrahydrobenz o[b]thiophen-3-yl)}carboxamide
| Molecular Formula | C20H24N2O2S |
|---|---|
| Molecular Weight | 356.16 g/mol |
| LogP | 4.13542 |
| 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 | 805.8488 |
Chemical Identifiers
| CAS Number | 312949-85-2 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)N(C)C)NC(=O)C3=CC=C(C=C3)C |
Product Overview
A2222/0093581 (CAS 312949-85-2), with molecular formula C20H24N2O2S and molecular weight 356.16 g/mol. IUPAC: N,N,6-trimethyl-2-[(4-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of A2222/0093581
Property Insights of A2222/0093581
The XLogP value of 4.13542 indicates that A2222/0093581 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, A2222/0093581 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2222/0093581 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 A2222/0093581?
The CAS number of A2222/0093581 is 312949-85-2.
What is the molecular formula of A2222/0093581?
The molecular formula of A2222/0093581 is C20H24N2O2S.
What is the molecular weight of A2222/0093581?
The molecular weight of A2222/0093581 is 356.16 g/mol.
Where can I buy A2222/0093581?
You can request a quote for A2222/0093581 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2222/0093581?
Yes, KEHONG BIO provides custom synthesis services for A2222/0093581 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.