6-Chloro-2,3,4,9-tetrahydro-1h-carbazol-1-amine - CAS 352553-60-7
Catalog: |
BB070413 |
Product Name: |
6-Chloro-2,3,4,9-tetrahydro-1h-carbazol-1-amine |
CAS: |
352553-60-7 |
Synonyms: |
6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-amine; 1H-CARBAZOL-1-AMINE, 6-CHLORO-2,3,4,9-TETRAHYDRO- |
IUPAC Name: | 6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-amine |
Description: | 6-Chloro-2,3,4,9-tetrahydro-1h-carbazol-1-amine can be used as human papillomaviruses inhibitors. |
Molecular Weight: | 220.69 |
Molecular Formula: | C12H13N2Cl |
Canonical SMILES: | C1CC(C2=C(C1)C3=C(N2)C=CC(=C3)Cl)N |
InChI: | InChI=1S/C12H13ClN2/c13-7-4-5-11-9(6-7)8-2-1-3-10(14)12(8)15-11/h4-6,10,15H,1-3,14H2 |
InChI Key: | BWLLTVHXDXVUIQ-UHFFFAOYSA-N |
References: | Boggs, S.D., et.al. WIPO WO2004110999 A1, (2004). |
Complexity: | 246 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.0767261 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.0767261 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.8Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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