AI34235
1403901-49-4 | tert-Butyl 6-bromo-3,3-dimethyl-1h,2h,3h-pyrrolo[3,2-b]pyridine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI34235
ChemicalName
tert-Butyl 6-bromo-3,3-dimethyl-1h,2h,3h-pyrrolo[3,2-b]pyridine-1-carboxylate
CasNumber
1403901-49-4
MolecularFormula
C14H19BrN2O2
MolecularWeight
327.2169
MdlNumber
MFCD24857263
Smiles
O=C(N1CC(c2c1cc(Br)cn2)(C)C)OC(C)(C)C
Complexity
365
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
3.2
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CatalogNumber: AI34235
ChemicalName: tert-Butyl 6-bromo-3,3-dimethyl-1h,2h,3h-pyrrolo[3,2-b]pyridine-1-carboxylate
CasNumber: 1403901-49-4
MolecularFormula: C14H19BrN2O2
MolecularWeight: 327.2169
MdlNumber: MFCD24857263
Smiles: O=C(N1CC(c2c1cc(Br)cn2)(C)C)OC(C)(C)C
Complexity: 365
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AI34235
ChemicalName:
tert-Butyl 6-bromo-3,3-dimethyl-1h,2h,3h-pyrrolo[3,2-b]pyridine-1-carboxylate
CasNumber:
1403901-49-4
MolecularFormula:
C14H19BrN2O2
MolecularWeight:
327.2169
MdlNumber:
MFCD24857263
Smiles:
O=C(N1CC(c2c1cc(Br)cn2)(C)C)OC(C)(C)C
Complexity:
365
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3.2
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Smiles: OC(=O)c1ncccc1Br.Cl
Complexity: 140
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Smiles:
OC(=O)c1ncccc1Br.Cl
Complexity:
140
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COc1ccc(cc1)c1nn(c(c1)O)c1ccccn1
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Smiles:
COc1ccc(cc1)c1nn(c(c1)O)c1ccccn1
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Smiles: S=C=Nc1cc(C)cc(c1)F
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MolecularFormula:
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MolecularWeight:
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Smiles:
S=C=Nc1cc(C)cc(c1)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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