AI36510
1480681-62-6 | tert-Butyl (1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl)carbamate
Manufacturer: A2B Chem
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CatalogNumber
AI36510
ChemicalName
tert-Butyl (1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl)carbamate
CasNumber
1480681-62-6
MolecularFormula
C13H18N4O2
MolecularWeight
262.3076
MdlNumber
MFCD21170056
Smiles
O=C(OC(C)(C)C)NC(c1nnc2n1cccc2)C
Complexity
329
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
2.1
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CatalogNumber: AI36510
ChemicalName: tert-Butyl (1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl)carbamate
CasNumber: 1480681-62-6
MolecularFormula: C13H18N4O2
MolecularWeight: 262.3076
MdlNumber: MFCD21170056
Smiles: O=C(OC(C)(C)C)NC(c1nnc2n1cccc2)C
Complexity: 329
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.1
CatalogNumber:
AI36510
ChemicalName:
tert-Butyl (1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl)carbamate
CasNumber:
1480681-62-6
MolecularFormula:
C13H18N4O2
MolecularWeight:
262.3076
MdlNumber:
MFCD21170056
Smiles:
O=C(OC(C)(C)C)NC(c1nnc2n1cccc2)C
Complexity:
329
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.1
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Smiles: Brc1ccc(cc1)c1nc(C)ncc1C(=O)O
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Smiles:
Brc1ccc(cc1)c1nc(C)ncc1C(=O)O
Complexity:
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__
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Smiles: OC(=O)C1CCc2c(C1)occ2
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HeavyAtomCount: __
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MolecularFormula:
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Smiles:
OC(=O)C1CCc2c(C1)occ2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: COc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)Cl)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)Cl)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__