AD63481
1133115-42-0 | Methyl 2-amino-4-cyclopropylpyrimidine-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AD63481
ChemicalName
Methyl 2-amino-4-cyclopropylpyrimidine-5-carboxylate
CasNumber
1133115-42-0
MolecularFormula
C9H11N3O2
MolecularWeight
193.2025
MdlNumber
MFCD11855863
Smiles
COC(=O)c1cnc(nc1C1CC1)N
Complexity
230
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.3
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CatalogNumber: AD63481
ChemicalName: Methyl 2-amino-4-cyclopropylpyrimidine-5-carboxylate
CasNumber: 1133115-42-0
MolecularFormula: C9H11N3O2
MolecularWeight: 193.2025
MdlNumber: MFCD11855863
Smiles: COC(=O)c1cnc(nc1C1CC1)N
Complexity: 230
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.3
CatalogNumber:
AD63481
ChemicalName:
Methyl 2-amino-4-cyclopropylpyrimidine-5-carboxylate
CasNumber:
1133115-42-0
MolecularFormula:
C9H11N3O2
MolecularWeight:
193.2025
MdlNumber:
MFCD11855863
Smiles:
COC(=O)c1cnc(nc1C1CC1)N
Complexity:
230
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.3
CatalogNumber: AD63482
ChemicalName: 3-Bromo-N-(4-methoxybenzyl)-2-nitroaniline
CasNumber: 1133115-36-2
MolecularFormula: C14H13BrN2O3
MolecularWeight: 337.1686
MdlNumber: MFCD11855828
Smiles: COc1ccc(cc1)CNc1cccc(c1[N+](=O)[O-])Br
Complexity: 316
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 4.4
CatalogNumber:
AD63482
ChemicalName:
3-Bromo-N-(4-methoxybenzyl)-2-nitroaniline
CasNumber:
1133115-36-2
MolecularFormula:
C14H13BrN2O3
MolecularWeight:
337.1686
MdlNumber:
MFCD11855828
Smiles:
COc1ccc(cc1)CNc1cccc(c1[N+](=O)[O-])Br
Complexity:
316
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
4.4
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Smiles: CSCn1c(C)ncc1[N+](=O)[O-]
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CSCn1c(C)ncc1[N+](=O)[O-]
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Smiles: COc1cc2ccn(c2cc1N)C(=O)CN(C)C
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Smiles:
COc1cc2ccn(c2cc1N)C(=O)CN(C)C
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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