AI16312
1251009-25-2 | 3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)indolizine-6-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI16312
ChemicalName
3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)indolizine-6-carboxylic acid
CasNumber
1251009-25-2
MolecularFormula
C18H23N3O4
MolecularWeight
345.3929
MdlNumber
MFCD14581128
Smiles
O=C(N1CCN(CC1)c1ccc2n1cc(cc2)C(=O)O)OC(C)(C)C
Complexity
511
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3.1
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CatalogNumber: AI16312
ChemicalName: 3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)indolizine-6-carboxylic acid
CasNumber: 1251009-25-2
MolecularFormula: C18H23N3O4
MolecularWeight: 345.3929
MdlNumber: MFCD14581128
Smiles: O=C(N1CCN(CC1)c1ccc2n1cc(cc2)C(=O)O)OC(C)(C)C
Complexity: 511
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.1
CatalogNumber:
AI16312
ChemicalName:
3-(4-(tert-Butoxycarbonyl)piperazin-1-yl)indolizine-6-carboxylic acid
CasNumber:
1251009-25-2
MolecularFormula:
C18H23N3O4
MolecularWeight:
345.3929
MdlNumber:
MFCD14581128
Smiles:
O=C(N1CCN(CC1)c1ccc2n1cc(cc2)C(=O)O)OC(C)(C)C
Complexity:
511
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.1
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Smiles: O=C(N1CC2(C1)CNCCCO2)OC(C)(C)C
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O=C(N1CC2(C1)CNCCCO2)OC(C)(C)C
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Smiles: NCc1ncn2c1CCN(CC2)C(=O)OC(C)(C)C
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NCc1ncn2c1CCN(CC2)C(=O)OC(C)(C)C
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CC2C(C1)(N)CC2)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CC2C(C1)(N)CC2)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__