AX55469
2096996-90-4 | 1-(5-Chloro-2-methoxyphenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
Manufacturer: A2B Chem
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CatalogNumber
AX55469
ChemicalName
1-(5-Chloro-2-methoxyphenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
CasNumber
2096996-90-4
MolecularFormula
C20H24BClN2O4
MolecularWeight
402.6796
MdlNumber
MFCD20231473
Smiles
COc1ccc(cc1NC(=O)Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C)Cl
Complexity
546
Covalently-bondedUnitCount
1
HeavyAtomCount
28
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
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CatalogNumber: AX55469
ChemicalName: 1-(5-Chloro-2-methoxyphenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
CasNumber: 2096996-90-4
MolecularFormula: C20H24BClN2O4
MolecularWeight: 402.6796
MdlNumber: MFCD20231473
Smiles: COc1ccc(cc1NC(=O)Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C)Cl
Complexity: 546
Covalently-bondedUnitCount: 1
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
CatalogNumber:
AX55469
ChemicalName:
1-(5-Chloro-2-methoxyphenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
CasNumber:
2096996-90-4
MolecularFormula:
C20H24BClN2O4
MolecularWeight:
402.6796
MdlNumber:
MFCD20231473
Smiles:
COc1ccc(cc1NC(=O)Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C)Cl
Complexity:
546
Covalently-bondedUnitCount:
1
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
CatalogNumber: AX55470
ChemicalName: 3-Chloro-4-ethoxy-5-propoxyphenylboronic acid
CasNumber: 2096335-27-0
MolecularFormula: C11H16BClO4
MolecularWeight: 258.5063
MdlNumber: MFCD21332924
Smiles: CCCOc1cc(cc(c1OCC)Cl)B(O)O
Complexity: 218
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 6
CatalogNumber:
AX55470
ChemicalName:
3-Chloro-4-ethoxy-5-propoxyphenylboronic acid
CasNumber:
2096335-27-0
MolecularFormula:
C11H16BClO4
MolecularWeight:
258.5063
MdlNumber:
MFCD21332924
Smiles:
CCCOc1cc(cc(c1OCC)Cl)B(O)O
Complexity:
218
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
6
CatalogNumber: AX55471
ChemicalName: 5-chloro-2,3-dimethoxypyridine-4-boronic acid
CasNumber: 2096339-93-2
MolecularFormula: C7H9BClNO4
MolecularWeight: 217.4147
MdlNumber: MFCD20231439
Smiles: COc1c(OC)ncc(c1B(O)O)Cl
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55471
ChemicalName:
5-chloro-2,3-dimethoxypyridine-4-boronic acid
CasNumber:
2096339-93-2
MolecularFormula:
C7H9BClNO4
MolecularWeight:
217.4147
MdlNumber:
MFCD20231439
Smiles:
COc1c(OC)ncc(c1B(O)O)Cl
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
CatalogNumber: AX55472
ChemicalName: 3-Chloro-2-(cyclopentyloxy)pyridine-4-boronic acid
CasNumber: 2096337-04-9
MolecularFormula: C10H13BClNO3
MolecularWeight: 241.4791
MdlNumber: MFCD21609520
Smiles: OB(c1ccnc(c1Cl)OC1CCCC1)O
Complexity: 226
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AX55472
ChemicalName:
3-Chloro-2-(cyclopentyloxy)pyridine-4-boronic acid
CasNumber:
2096337-04-9
MolecularFormula:
C10H13BClNO3
MolecularWeight:
241.4791
MdlNumber:
MFCD21609520
Smiles:
OB(c1ccnc(c1Cl)OC1CCCC1)O
Complexity:
226
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3