AB75571
1187385-80-3 | Methyl 2-amino-4-(3-methoxyphenyl)pyrimidine-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB75571
ChemicalName
Methyl 2-amino-4-(3-methoxyphenyl)pyrimidine-5-carboxylate
CasNumber
1187385-80-3
MolecularFormula
C13H13N3O3
MolecularWeight
259.2606
MdlNumber
MFCD12756429
Smiles
COc1cccc(c1)c1nc(N)ncc1C(=O)OC
Complexity
314
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.3
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CatalogNumber: AB75571
ChemicalName: Methyl 2-amino-4-(3-methoxyphenyl)pyrimidine-5-carboxylate
CasNumber: 1187385-80-3
MolecularFormula: C13H13N3O3
MolecularWeight: 259.2606
MdlNumber: MFCD12756429
Smiles: COc1cccc(c1)c1nc(N)ncc1C(=O)OC
Complexity: 314
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.3
CatalogNumber:
AB75571
ChemicalName:
Methyl 2-amino-4-(3-methoxyphenyl)pyrimidine-5-carboxylate
CasNumber:
1187385-80-3
MolecularFormula:
C13H13N3O3
MolecularWeight:
259.2606
MdlNumber:
MFCD12756429
Smiles:
COc1cccc(c1)c1nc(N)ncc1C(=O)OC
Complexity:
314
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.3
CatalogNumber: AB75572
ChemicalName: Methyl 2-amino-4-(3-methoxyphenyl)thiazole-5-carboxylate
CasNumber: 1133115-46-4
MolecularFormula: C12H12N2O3S
MolecularWeight: 264.3003
MdlNumber: MFCD11855865
Smiles: COc1cccc(c1)c1nc(sc1C(=O)OC)N
Complexity: 303
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.4
CatalogNumber:
AB75572
ChemicalName:
Methyl 2-amino-4-(3-methoxyphenyl)thiazole-5-carboxylate
CasNumber:
1133115-46-4
MolecularFormula:
C12H12N2O3S
MolecularWeight:
264.3003
MdlNumber:
MFCD11855865
Smiles:
COc1cccc(c1)c1nc(sc1C(=O)OC)N
Complexity:
303
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.4
CatalogNumber: AB75573
ChemicalName: Methyl 2-amino-4-(4-chlorophenyl)pyrimidine-5-carboxylate
CasNumber: 1133115-56-6
MolecularFormula: C12H10ClN3O2
MolecularWeight: 263.6797
MdlNumber: MFCD11855874
Smiles: COC(=O)c1cnc(nc1c1ccc(cc1)Cl)N
Complexity: 295
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AB75573
ChemicalName:
Methyl 2-amino-4-(4-chlorophenyl)pyrimidine-5-carboxylate
CasNumber:
1133115-56-6
MolecularFormula:
C12H10ClN3O2
MolecularWeight:
263.6797
MdlNumber:
MFCD11855874
Smiles:
COC(=O)c1cnc(nc1c1ccc(cc1)Cl)N
Complexity:
295
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)c1cnc(nc1c1ccc(cc1)F)N
Complexity: 295
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(=O)c1cnc(nc1c1ccc(cc1)F)N
Complexity:
295
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.5