AA90930
168824-94-0 | tert-Butyl 3,4-dihydro-1h-pyrido[3,4-b]indole-2(9h)-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA90930
ChemicalName
tert-Butyl 3,4-dihydro-1h-pyrido[3,4-b]indole-2(9h)-carboxylate
CasNumber
168824-94-0
MolecularFormula
C16H20N2O2
MolecularWeight
272.3422
MdlNumber
MFCD09029520
Smiles
O=C(N1CCc2c(C1)[nH]c1c2cccc1)OC(C)(C)C
Complexity
377
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.8
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CatalogNumber: AA90930
ChemicalName: tert-Butyl 3,4-dihydro-1h-pyrido[3,4-b]indole-2(9h)-carboxylate
CasNumber: 168824-94-0
MolecularFormula: C16H20N2O2
MolecularWeight: 272.3422
MdlNumber: MFCD09029520
Smiles: O=C(N1CCc2c(C1)[nH]c1c2cccc1)OC(C)(C)C
Complexity: 377
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.8
CatalogNumber:
AA90930
ChemicalName:
tert-Butyl 3,4-dihydro-1h-pyrido[3,4-b]indole-2(9h)-carboxylate
CasNumber:
168824-94-0
MolecularFormula:
C16H20N2O2
MolecularWeight:
272.3422
MdlNumber:
MFCD09029520
Smiles:
O=C(N1CCc2c(C1)[nH]c1c2cccc1)OC(C)(C)C
Complexity:
377
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.8
CatalogNumber: AA90932
ChemicalName: 5-Bromo-2-(chloromethyl)pyridine
CasNumber: 168823-76-5
MolecularFormula: C6H5BrClN
MolecularWeight: 206.4676
MdlNumber: MFCD10697592
Smiles: ClCc1ccc(cn1)Br
Complexity: 89.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AA90932
ChemicalName:
5-Bromo-2-(chloromethyl)pyridine
CasNumber:
168823-76-5
MolecularFormula:
C6H5BrClN
MolecularWeight:
206.4676
MdlNumber:
MFCD10697592
Smiles:
ClCc1ccc(cn1)Br
Complexity:
89.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: AA90933
ChemicalName: 2-(3-Bromo-4-methoxyphenyl)pyridine
CasNumber: 168823-65-2
MolecularFormula: C12H10BrNO
MolecularWeight: 264.1179
MdlNumber: MFCD05864835
Smiles: COc1ccc(cc1Br)c1ccccn1
Complexity: 200
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AA90933
ChemicalName:
2-(3-Bromo-4-methoxyphenyl)pyridine
CasNumber:
168823-65-2
MolecularFormula:
C12H10BrNO
MolecularWeight:
264.1179
MdlNumber:
MFCD05864835
Smiles:
COc1ccc(cc1Br)c1ccccn1
Complexity:
200
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: AA90934
ChemicalName: 1-(3-Bromobenzyl)pyrrolidine
CasNumber: 168820-15-3
MolecularFormula: C11H14BrN
MolecularWeight: 240.1396
MdlNumber: MFCD06080721
Smiles: Brc1cccc(c1)CN1CCCC1
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 3.5
CatalogNumber:
AA90934
ChemicalName:
1-(3-Bromobenzyl)pyrrolidine
CasNumber:
168820-15-3
MolecularFormula:
C11H14BrN
MolecularWeight:
240.1396
MdlNumber:
MFCD06080721
Smiles:
Brc1cccc(c1)CN1CCCC1
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
3.5