AA72969
145013-05-4 | N,N'-Bis-tert-butoxycarbonylthiourea
Manufacturer: A2B Chem
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CatalogNumber
AA72969
ChemicalName
N,N'-Bis-tert-butoxycarbonylthiourea
CasNumber
145013-05-4
MolecularFormula
C11H20N2O4S
MolecularWeight
276.3525
MdlNumber
MFCD03093917
Smiles
S=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
Complexity
310
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
3.4
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CatalogNumber: AA72969
ChemicalName: N,N'-Bis-tert-butoxycarbonylthiourea
CasNumber: 145013-05-4
MolecularFormula: C11H20N2O4S
MolecularWeight: 276.3525
MdlNumber: MFCD03093917
Smiles: S=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
Complexity: 310
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 3.4
CatalogNumber:
AA72969
ChemicalName:
N,N'-Bis-tert-butoxycarbonylthiourea
CasNumber:
145013-05-4
MolecularFormula:
C11H20N2O4S
MolecularWeight:
276.3525
MdlNumber:
MFCD03093917
Smiles:
S=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C
Complexity:
310
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@@H]1CC[C@@H]2N(C1)CCNC2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@@H]1CC[C@@H]2N(C1)CCNC2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@H]1CC[C@@H](NC1)C(=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@H]1CC[C@@H](NC1)C(=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)[C@H]1CC[C@@H](CN1CCN1C(=O)c2c(C1=O)cccc2)C(=O)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)[C@H]1CC[C@@H](CN1CCN1C(=O)c2c(C1=O)cccc2)C(=O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__