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Home > Aldehydes > 303987-22-6
303987-22-6 | 2-(4-BENZYLPIPERAZINO)-1,3-THIAZOLE-5-CARBALDEHYDE
CAS No: 303987-22-6 Catalog No: AG00BGZM MDL No:MFCD01568829
Product Description
Catalog Number:
AG00BGZM
Chemical Name:
2-(4-BENZYLPIPERAZINO)-1,3-THIAZOLE-5-CARBALDEHYDE
CAS Number:
303987-22-6
Molecular Formula:
C15H17N3OS
Molecular Weight:
287.3800
MDL Number:
MFCD01568829
IUPAC Name:
2-(4-benzylpiperazin-1-yl)-1,3-thiazole-5-carbaldehyde
InChI:
InChI=1S/C15H17N3OS/c19-12-14-10-16-15(20-14)18-8-6-17(7-9-18)11-13-4-2-1-3-5-13/h1-5,10,12H,6-9,11H2
InChI Key:
ICEJWPVGLIEGTK-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(s1)N1CCN(CC1)Cc1ccccc1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.109g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.381g/mol
Monoisotopic Mass:
287.109g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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 |
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