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74978-28-2 | (2-amino-5-chlorophenyl)(1h-pyrrol-2-yl)methanone
CAS No: 74978-28-2 Catalog No: AG0057IC MDL No:MFCD00191729
Product Description
Catalog Number:
AG0057IC
Chemical Name:
(2-amino-5-chlorophenyl)(1h-pyrrol-2-yl)methanone
CAS Number:
74978-28-2
Molecular Formula:
C11H9ClN2O
Molecular Weight:
220.6550
MDL Number:
MFCD00191729
IUPAC Name:
(2-amino-5-chlorophenyl)-(1H-pyrrol-2-yl)methanone
InChI:
InChI=1S/C11H9ClN2O/c12-7-3-4-9(13)8(6-7)11(15)10-2-1-5-14-10/h1-6,14H,13H2
InChI Key:
GUAGHTDLIMFQDF-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C(=O)c1[nH]ccc1)N
NSC Number:
140872
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.04g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.656g/mol
Monoisotopic Mass:
220.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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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