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20532-28-9 | Benzo[b]thiophen-5-amine
CAS No: 20532-28-9 Catalog No: AG002A0O MDL No:MFCD04115381
Product Description
Catalog Number:
AG002A0O
Chemical Name:
Benzo[b]thiophen-5-amine
CAS Number:
20532-28-9
Molecular Formula:
C8H7NS
Molecular Weight:
149.2129
MDL Number:
MFCD04115381
IUPAC Name:
1-benzothiophen-5-amine
InChI:
InChI=1S/C8H7NS/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5H,9H2
InChI Key:
ZUPYTANKWDPRDP-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)ccs2
NSC Number:
148327
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.211g/mol
Monoisotopic Mass:
149.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Antistaphylococcal activity of DNA-interactive pyrrolobenzodiazepine (PBD) dimers and PBD-biaryl conjugates. | The Journal of antimicrobial chemotherapy 20120701 |
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