AA50514
1373232-46-2 | t-Butyl N-[3-(butane-1-sulfonyl)phenyl]carbamate
Manufacturer: A2B Chem
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CatalogNumber
AA50514
ChemicalName
t-Butyl N-[3-(butane-1-sulfonyl)phenyl]carbamate
CasNumber
1373232-46-2
MolecularFormula
C15H23NO4S
MolecularWeight
313.4124
MdlNumber
MFCD22192556
Smiles
CCCCS(=O)(=O)c1cccc(c1)NC(=O)OC(C)(C)C
Complexity
434
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
7
Xlogp3
3
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CatalogNumber: AA50514
ChemicalName: t-Butyl N-[3-(butane-1-sulfonyl)phenyl]carbamate
CasNumber: 1373232-46-2
MolecularFormula: C15H23NO4S
MolecularWeight: 313.4124
MdlNumber: MFCD22192556
Smiles: CCCCS(=O)(=O)c1cccc(c1)NC(=O)OC(C)(C)C
Complexity: 434
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 7
Xlogp3: 3
CatalogNumber:
AA50514
ChemicalName:
t-Butyl N-[3-(butane-1-sulfonyl)phenyl]carbamate
CasNumber:
1373232-46-2
MolecularFormula:
C15H23NO4S
MolecularWeight:
313.4124
MdlNumber:
MFCD22192556
Smiles:
CCCCS(=O)(=O)c1cccc(c1)NC(=O)OC(C)(C)C
Complexity:
434
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
7
Xlogp3:
3
CatalogNumber: AA50515
ChemicalName: Methyl 4-(3-aminophenyl)-2-fluorobenzoate, HCl
CasNumber: 1373232-44-0
MolecularFormula: C14H13ClFNO2
MolecularWeight: 281.7099
MdlNumber: MFCD22192479
Smiles: COC(=O)c1ccc(cc1F)c1cccc(c1)N.Cl
Complexity: 298
Covalently-bondedUnitCount: 2
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AA50515
ChemicalName:
Methyl 4-(3-aminophenyl)-2-fluorobenzoate, HCl
CasNumber:
1373232-44-0
MolecularFormula:
C14H13ClFNO2
MolecularWeight:
281.7099
MdlNumber:
MFCD22192479
Smiles:
COC(=O)c1ccc(cc1F)c1cccc(c1)N.Cl
Complexity:
298
Covalently-bondedUnitCount:
2
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cncc(c1)c1ccc(cc1)C(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cncc(c1)c1ccc(cc1)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA50517
ChemicalName: Methyl 5-bromo-2-(1,1-dioxoisothiazolidin-2-yl)benzoate
CasNumber: 1373232-33-7
MolecularFormula: C11H12BrNO4S
MolecularWeight: 334.1863
MdlNumber: MFCD22192470
Smiles: COC(=O)c1cc(Br)ccc1N1CCCS1(=O)=O
Complexity: 419
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 1.7
CatalogNumber:
AA50517
ChemicalName:
Methyl 5-bromo-2-(1,1-dioxoisothiazolidin-2-yl)benzoate
CasNumber:
1373232-33-7
MolecularFormula:
C11H12BrNO4S
MolecularWeight:
334.1863
MdlNumber:
MFCD22192470
Smiles:
COC(=O)c1cc(Br)ccc1N1CCCS1(=O)=O
Complexity:
419
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
1.7