AI33732
1391738-60-5 | tert-Butyl 2,4-dioxo-1,3,7-triazaspiro[4.4]nonane-7-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI33732
ChemicalName
tert-Butyl 2,4-dioxo-1,3,7-triazaspiro[4.4]nonane-7-carboxylate
CasNumber
1391738-60-5
MolecularFormula
C11H17N3O4
MolecularWeight
255.2704
MdlNumber
MFCD22372527
Smiles
O=C1NC(=O)C2(N1)CCN(C2)C(=O)OC(C)(C)C
Complexity
415
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
-0.2
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CatalogNumber: AI33732
ChemicalName: tert-Butyl 2,4-dioxo-1,3,7-triazaspiro[4.4]nonane-7-carboxylate
CasNumber: 1391738-60-5
MolecularFormula: C11H17N3O4
MolecularWeight: 255.2704
MdlNumber: MFCD22372527
Smiles: O=C1NC(=O)C2(N1)CCN(C2)C(=O)OC(C)(C)C
Complexity: 415
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: -0.2
CatalogNumber:
AI33732
ChemicalName:
tert-Butyl 2,4-dioxo-1,3,7-triazaspiro[4.4]nonane-7-carboxylate
CasNumber:
1391738-60-5
MolecularFormula:
C11H17N3O4
MolecularWeight:
255.2704
MdlNumber:
MFCD22372527
Smiles:
O=C1NC(=O)C2(N1)CCN(C2)C(=O)OC(C)(C)C
Complexity:
415
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
-0.2
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Smiles: C#CCC1(CC1)NC(=O)OC(C)(C)C
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Smiles:
C#CCC1(CC1)NC(=O)OC(C)(C)C
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Smiles: CCC1(CC1)NC(=O)OC(C)(C)C
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Smiles:
CCC1(CC1)NC(=O)OC(C)(C)C
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HydrogenBondAcceptorCount:
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Smiles: COc1ccc(cc1)c1ccc(s1)C(=O)C
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Smiles:
COc1ccc(cc1)c1ccc(s1)C(=O)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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