AA50533
1373233-47-6 | t-Butyl N-[3-(propane-1-sulfonyl)phenyl]carbamate
Manufacturer: A2B Chem
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CatalogNumber
AA50533
ChemicalName
t-Butyl N-[3-(propane-1-sulfonyl)phenyl]carbamate
CasNumber
1373233-47-6
MolecularFormula
C14H21NO4S
MolecularWeight
299.3858
MdlNumber
MFCD22192555
Smiles
CCCS(=O)(=O)c1cccc(c1)NC(=O)OC(C)(C)C
Complexity
419
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
6
Xlogp3
2.6
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CatalogNumber: AA50533
ChemicalName: t-Butyl N-[3-(propane-1-sulfonyl)phenyl]carbamate
CasNumber: 1373233-47-6
MolecularFormula: C14H21NO4S
MolecularWeight: 299.3858
MdlNumber: MFCD22192555
Smiles: CCCS(=O)(=O)c1cccc(c1)NC(=O)OC(C)(C)C
Complexity: 419
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 2.6
CatalogNumber:
AA50533
ChemicalName:
t-Butyl N-[3-(propane-1-sulfonyl)phenyl]carbamate
CasNumber:
1373233-47-6
MolecularFormula:
C14H21NO4S
MolecularWeight:
299.3858
MdlNumber:
MFCD22192555
Smiles:
CCCS(=O)(=O)c1cccc(c1)NC(=O)OC(C)(C)C
Complexity:
419
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCN1C(=O)COc2c1cc(Br)cc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCN1C(=O)COc2c1cc(Br)cc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)C(c1ccc(cc1)F)NC(=O)C
Complexity: 308
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)C(c1ccc(cc1)F)NC(=O)C
Complexity:
308
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.8
CatalogNumber: AA50536
ChemicalName: N-[(4-Chlorophenyl)(3-fluorophenyl)methyl]acetamide
CasNumber: 1373233-43-2
MolecularFormula: C15H13ClFNO
MolecularWeight: 277.7212
MdlNumber: MFCD22192546
Smiles: CC(=O)NC(c1cccc(c1)F)c1ccc(cc1)Cl
Complexity: 305
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AA50536
ChemicalName:
N-[(4-Chlorophenyl)(3-fluorophenyl)methyl]acetamide
CasNumber:
1373233-43-2
MolecularFormula:
C15H13ClFNO
MolecularWeight:
277.7212
MdlNumber:
MFCD22192546
Smiles:
CC(=O)NC(c1cccc(c1)F)c1ccc(cc1)Cl
Complexity:
305
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.5