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5220-39-3 | 11H-Cyclohepta[b]quinolin-11-one,5,6,7,8,9,10-hexahydro-
CAS No: 5220-39-3 Catalog No: AG006VNO MDL No:MFCD00737303
Product Description
Catalog Number:
AG006VNO
Chemical Name:
11H-Cyclohepta[b]quinolin-11-one,5,6,7,8,9,10-hexahydro-
CAS Number:
5220-39-3
Molecular Formula:
C14H15NO
Molecular Weight:
213.2750
MDL Number:
MFCD00737303
IUPAC Name:
5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one
InChI:
InChI=1S/C14H15NO/c16-14-10-6-2-1-3-8-12(10)15-13-9-5-4-7-11(13)14/h4-5,7,9H,1-3,6,8H2,(H,15,16)
InChI Key:
LDMBBNQWWBTULE-UHFFFAOYSA-N
SMILES:
O=c1c2CCCCCc2[nH]c2c1cccc2
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.115g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.28g/mol
Monoisotopic Mass:
213.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| 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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