![3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide structure](/static/products/444/444930-75-0.png)
3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide
TL;DR: 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide (CAS 444930-75-0) is a chemical compound with molecular formula C22H21Cl2N3O2S2 and molecular weight 493.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide
Also Known As: 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide, 3,4-dichloro-N'-[4-methoxy-3-(4-thiomorpholinylmethyl)benzylidene]-1-benzothiophene-2-carbohydrazide, 3,4-dichloro-N'-{(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylidene}-1-benzothiophene-2-carbohydrazide, N-{(1E)-2-[4-methoxy-3-(1,4-thiazaperhydroin-4-ylmethyl)phenyl]-1-azavinyl}(3, 4-dichlorobenzo[b]thiophen-2-yl)carboxamide
| Molecular Formula | C22H21Cl2N3O2S2 |
|---|---|
| Molecular Weight | 493.05 g/mol |
| LogP | 5.5294 |
| Topological Polar Surface Area | 53.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.04523 |
| Heavy Atoms | 31 |
| Complexity | 1127.3867 |
Chemical Identifiers
| CAS Number | 444930-75-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(C3=C(S2)C=CC=C3Cl)Cl)CN4CCSCC4 |
Product Overview
3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide (CAS 444930-75-0), with molecular formula C22H21Cl2N3O2S2 and molecular weight 493.05 g/mol. IUPAC: 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide
Property Insights of 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide
The XLogP value of 5.5294 indicates that 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.93 Ų, 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide?
The CAS number of 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide is 444930-75-0.
What is the molecular formula of 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide?
The molecular formula of 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide is C22H21Cl2N3O2S2.
What is the molecular weight of 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide?
The molecular weight of 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide is 493.05 g/mol.
Where can I buy 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide?
You can request a quote for 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dichloro-N-[(E)-[4-methoxy-3-(thiomorpholin-4-ylmethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.