AX55399
2096997-11-2 | 1-(2,5-Dimethoxyphenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
Manufacturer: A2B Chem
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CatalogNumber
AX55399
ChemicalName
1-(2,5-Dimethoxyphenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
CasNumber
2096997-11-2
MolecularFormula
C21H27BN2O5
MolecularWeight
398.2605
MdlNumber
MFCD20231485
Smiles
COc1ccc(cc1NC(=O)Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C)OC
Complexity
557
Covalently-bondedUnitCount
1
HeavyAtomCount
29
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
5
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CatalogNumber: AX55399
ChemicalName: 1-(2,5-Dimethoxyphenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
CasNumber: 2096997-11-2
MolecularFormula: C21H27BN2O5
MolecularWeight: 398.2605
MdlNumber: MFCD20231485
Smiles: COc1ccc(cc1NC(=O)Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C)OC
Complexity: 557
Covalently-bondedUnitCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 5
CatalogNumber:
AX55399
ChemicalName:
1-(2,5-Dimethoxyphenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
CasNumber:
2096997-11-2
MolecularFormula:
C21H27BN2O5
MolecularWeight:
398.2605
MdlNumber:
MFCD20231485
Smiles:
COc1ccc(cc1NC(=O)Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C)OC
Complexity:
557
Covalently-bondedUnitCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(c(c1F)B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity: 398
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(c(c1F)B1OC(C(O1)(C)C)(C)C)[N+](=O)[O-]
Complexity:
398
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: AX55401
ChemicalName: 3-Chloro-2-isopropoxypyridine-4-boronic acid
CasNumber: 2096341-71-6
MolecularFormula: C8H11BClNO3
MolecularWeight: 215.4418
MdlNumber: MFCD18914509
Smiles: CC(Oc1nccc(c1Cl)B(O)O)C
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55401
ChemicalName:
3-Chloro-2-isopropoxypyridine-4-boronic acid
CasNumber:
2096341-71-6
MolecularFormula:
C8H11BClNO3
MolecularWeight:
215.4418
MdlNumber:
MFCD18914509
Smiles:
CC(Oc1nccc(c1Cl)B(O)O)C
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AX55402
ChemicalName: 3-chloro-4-isopropoxy-5-methoxyphenylboronic acid
CasNumber: 2096341-61-4
MolecularFormula: C10H14BClO4
MolecularWeight: 244.4798
MdlNumber: MFCD21332922
Smiles: COc1cc(cc(c1OC(C)C)Cl)B(O)O
Complexity: 215
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55402
ChemicalName:
3-chloro-4-isopropoxy-5-methoxyphenylboronic acid
CasNumber:
2096341-61-4
MolecularFormula:
C10H14BClO4
MolecularWeight:
244.4798
MdlNumber:
MFCD21332922
Smiles:
COc1cc(cc(c1OC(C)C)Cl)B(O)O
Complexity:
215
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4