AB10583
201531-76-2 | Fmoc-pen(acm)-oh
Manufacturer: A2B Chem
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CatalogNumber
AB10583
ChemicalName
Fmoc-pen(acm)-oh
CasNumber
201531-76-2
MolecularFormula
C23H26N2O5S
MolecularWeight
442.52793999999994
MdlNumber
MFCD00151935
Smiles
CC(=O)NCSC([C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2)(C)C
Complexity
648
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
31
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
9
Xlogp3
3.4
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CatalogNumber: AB10583
ChemicalName: Fmoc-pen(acm)-oh
CasNumber: 201531-76-2
MolecularFormula: C23H26N2O5S
MolecularWeight: 442.52793999999994
MdlNumber: MFCD00151935
Smiles: CC(=O)NCSC([C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2)(C)C
Complexity: 648
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 9
Xlogp3: 3.4
CatalogNumber:
AB10583
ChemicalName:
Fmoc-pen(acm)-oh
CasNumber:
201531-76-2
MolecularFormula:
C23H26N2O5S
MolecularWeight:
442.52793999999994
MdlNumber:
MFCD00151935
Smiles:
CC(=O)NCSC([C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2)(C)C
Complexity:
648
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
9
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1ccc2c(c1)[nH]c(=O)o2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1ccc2c(c1)[nH]c(=O)o2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB10586
ChemicalName: 4-[bis(2-hydroxyphenyl)-1H-1,2,4-triazol-1-yl]benzoic acid
CasNumber: 201530-41-8
MolecularFormula: C21H15N3O4
MolecularWeight: 373.3615
MdlNumber: MFCD09751362
Smiles: OC(=O)c1ccc(cc1)n1nc(nc1c1ccccc1O)c1ccccc1O
Complexity: 540
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 4
Xlogp3: 3.8
CatalogNumber:
AB10586
ChemicalName:
4-[bis(2-hydroxyphenyl)-1H-1,2,4-triazol-1-yl]benzoic acid
CasNumber:
201530-41-8
MolecularFormula:
C21H15N3O4
MolecularWeight:
373.3615
MdlNumber:
MFCD09751362
Smiles:
OC(=O)c1ccc(cc1)n1nc(nc1c1ccccc1O)c1ccccc1O
Complexity:
540
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
4
Xlogp3:
3.8
CatalogNumber: AB10588
ChemicalName: 3-Trifluoromethyl-1H-pyrazole
CasNumber: 20154-03-4
MolecularFormula: C4H3F3N2
MolecularWeight: 136.0752
MdlNumber: MFCD00115018
Smiles: FC(c1cc[nH]n1)(F)F
Complexity: 101
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.1
CatalogNumber:
AB10588
ChemicalName:
3-Trifluoromethyl-1H-pyrazole
CasNumber:
20154-03-4
MolecularFormula:
C4H3F3N2
MolecularWeight:
136.0752
MdlNumber:
MFCD00115018
Smiles:
FC(c1cc[nH]n1)(F)F
Complexity:
101
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.1