AX11714
1956364-17-2 | Di-tert-butyl 6-fluoro-1,4-diazepane-1,4-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AX11714
ChemicalName
Di-tert-butyl 6-fluoro-1,4-diazepane-1,4-dicarboxylate
CasNumber
1956364-17-2
MolecularFormula
C15H27FN2O4
MolecularWeight
318.3843
MdlNumber
MFCD29917107
Smiles
FC1CN(CCN(C1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
Complexity
377
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
2.2
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CatalogNumber: AX11714
ChemicalName: Di-tert-butyl 6-fluoro-1,4-diazepane-1,4-dicarboxylate
CasNumber: 1956364-17-2
MolecularFormula: C15H27FN2O4
MolecularWeight: 318.3843
MdlNumber: MFCD29917107
Smiles: FC1CN(CCN(C1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
Complexity: 377
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 2.2
CatalogNumber:
AX11714
ChemicalName:
Di-tert-butyl 6-fluoro-1,4-diazepane-1,4-dicarboxylate
CasNumber:
1956364-17-2
MolecularFormula:
C15H27FN2O4
MolecularWeight:
318.3843
MdlNumber:
MFCD29917107
Smiles:
FC1CN(CCN(C1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
Complexity:
377
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
2.2
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Smiles: CC(=O)c1ccc(c(c1)CS(=O)(=O)C)OCc1ccccc1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
CC(=O)c1ccc(c(c1)CS(=O)(=O)C)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: O=C(OC(C)(C)C)NC1CN(CC21COC2)Cc1ccccc1
Complexity: 423
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 2
CatalogNumber:
__
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(OC(C)(C)C)NC1CN(CC21COC2)Cc1ccccc1
Complexity:
423
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(C(c1ccccc1)NC(=O)OC(C)(C)C)N1CCCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(C(c1ccccc1)NC(=O)OC(C)(C)C)N1CCCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__