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Home > Indoles and Oxindole > 338981-81-0
338981-81-0 | 3-methoxypyrido[1,2-a]indole-10-carbonitrile
CAS No: 338981-81-0 Catalog No: AG00IZ55 MDL No:MFCD01568584
Product Description
Catalog Number:
AG00IZ55
Chemical Name:
3-methoxypyrido[1,2-a]indole-10-carbonitrile
CAS Number:
338981-81-0
Molecular Formula:
C14H10N2O
Molecular Weight:
222.2420
MDL Number:
MFCD01568584
IUPAC Name:
3-methoxypyrido[1,2-a]indole-10-carbonitrile
InChI:
InChI=1S/C14H10N2O/c1-17-10-5-6-11-12(9-15)13-4-2-3-7-16(13)14(11)8-10/h2-8H,1H3
InChI Key:
XFTUIYAMZMOGOC-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)n1ccccc1c2C#N
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.247g/mol
Monoisotopic Mass:
222.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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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