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Home Other Building Blocks 4-(4-METHOXYPHENYL)-4,5,6,7-TETRAHYDROTHIENO[3,2-C]PYRIDINE

4-(4-METHOXYPHENYL)-4,5,6,7-TETRAHYDROTHIENO[3,2-C]PYRIDINE

CAS No.:
213462-19-2
Catalog Number:
AG00BEQO
Molecular Formula:
C14H15NOS
Molecular Weight:
245.3400
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Product Description
Catalog Number:
AG00BEQO
Chemical Name:
4-(4-METHOXYPHENYL)-4,5,6,7-TETRAHYDROTHIENO[3,2-C]PYRIDINE
CAS Number:
213462-19-2
Molecular Formula:
C14H15NOS
Molecular Weight:
245.3400
MDL Number:
MFCD00177096
IUPAC Name:
4-(4-methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
InChI:
InChI=1S/C14H15NOS/c1-16-11-4-2-10(3-5-11)14-12-7-9-17-13(12)6-8-15-14/h2-5,7,9,14-15H,6,8H2,1H3
InChI Key:
YZMKEDMYYJQGRD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1NCCc2c1ccs2
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.087g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.34g/mol
Monoisotopic Mass:
245.087g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties