AB52402
4572-03-6 | 3-(4-Methylpiperazin-1-yl)propan-1-amine
Manufacturer: A2B Chem
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CatalogNumber
AB52402
ChemicalName
3-(4-Methylpiperazin-1-yl)propan-1-amine
CasNumber
4572-03-6
MolecularFormula
C8H19N3
MolecularWeight
157.2566
MdlNumber
MFCD00014616
Smiles
NCCCN1CCN(CC1)C
NscNumber
60215
Complexity
97.5
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
-0.8
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CatalogNumber: AB52402
ChemicalName: 3-(4-Methylpiperazin-1-yl)propan-1-amine
CasNumber: 4572-03-6
MolecularFormula: C8H19N3
MolecularWeight: 157.2566
MdlNumber: MFCD00014616
Smiles: NCCCN1CCN(CC1)C
NscNumber: 60215
Complexity: 97.5
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: -0.8
CatalogNumber:
AB52402
ChemicalName:
3-(4-Methylpiperazin-1-yl)propan-1-amine
CasNumber:
4572-03-6
MolecularFormula:
C8H19N3
MolecularWeight:
157.2566
MdlNumber:
MFCD00014616
Smiles:
NCCCN1CCN(CC1)C
NscNumber:
60215
Complexity:
97.5
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
-0.8
CatalogNumber: AB52403
ChemicalName: 4-Bromo-3-hydroxybenzonitrile
CasNumber: 916213-60-0
MolecularFormula: C7H4BrNO
MolecularWeight: 198.0168
MdlNumber: MFCD16999194
Smiles: N#Cc1ccc(c(c1)O)Br
NscNumber: __
Complexity: 162
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.2
CatalogNumber:
AB52403
ChemicalName:
4-Bromo-3-hydroxybenzonitrile
CasNumber:
916213-60-0
MolecularFormula:
C7H4BrNO
MolecularWeight:
198.0168
MdlNumber:
MFCD16999194
Smiles:
N#Cc1ccc(c(c1)O)Br
NscNumber:
__
Complexity:
162
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.2
CatalogNumber: AB52404
ChemicalName: Ethyl 2-bromothiophene-3-carboxylate
CasNumber: 632325-50-9
MolecularFormula: C7H7BrO2S
MolecularWeight: 235.0983
MdlNumber: MFCD09965551
Smiles: CCOC(=O)c1ccsc1Br
NscNumber: __
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 2.8
CatalogNumber:
AB52404
ChemicalName:
Ethyl 2-bromothiophene-3-carboxylate
CasNumber:
632325-50-9
MolecularFormula:
C7H7BrO2S
MolecularWeight:
235.0983
MdlNumber:
MFCD09965551
Smiles:
CCOC(=O)c1ccsc1Br
NscNumber:
__
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
2.8
CatalogNumber: AB52405
ChemicalName: 7-Bromo-3h-imidazo[4,5-b]pyridine
CasNumber: 1207174-85-3
MolecularFormula: C6H4BrN3
MolecularWeight: 198.0201
MdlNumber: MFCD11846335
Smiles: Brc1ccnc2c1nc[nH]2
NscNumber: __
Complexity: 130
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
AB52405
ChemicalName:
7-Bromo-3h-imidazo[4,5-b]pyridine
CasNumber:
1207174-85-3
MolecularFormula:
C6H4BrN3
MolecularWeight:
198.0201
MdlNumber:
MFCD11846335
Smiles:
Brc1ccnc2c1nc[nH]2
NscNumber:
__
Complexity:
130
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.4