N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)

C180H257N35O21S6 — CID 159584101

IUPACN-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)
SMILESCCCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.CCCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CCN4CCCCC4)CC3)n2)c1.CCCOc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CCN4CCCCC4)CC3)n2)c1.CCCOc1ccc(OC)c(C2=CCC(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)=N2)c1.CCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.CCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.COc1ccc(C2CCCC2)cc1-c1csc(NC(=O)N2CCN(CC(=O)N3CCCCC3)CC2)n1
InChIInChI=1S/C27H37N5O3S.C26H37N5O4.C26H37N5O3S.C26H39N5O2S.C25H37N5O3S.2C25H35N5O3S/c1-35-24-10-9-21(20-7-3-4-8-20)17-22(24)23-19-36-26(28-23)29-27(34)32-15-13-30(14-16-32)18-25(33)31-11-5-2-6-12-31;1-3-17-35-20-7-9-23(34-2)21(18-20)22-8-10-24(27-22)28-26(33)31-15-13-29(14-16-31)19-25(32)30-11-5-4-6-12-30;1-3-4-8-20-9-10-23(34-2)21(17-20)22-19-35-25(27-22)28-26(33)31-15-13-29(14-16-31)18-24(32)30-11-6-5-7-12-30;1-3-4-8-21-9-10-24(33-2)22(19-21)23-20-34-25(27-23)28-26(32)31-17-15-30(16-18-31)14-13-29-11-6-5-7-12-29;1-3-17-33-20-7-8-23(32-2)21(18-20)22-19-34-24(26-22)27-25(31)30-15-13-29(14-16-30)12-11-28-9-5-4-6-10-28;2*1-3-7-19-8-9-22(33-2)20(16-19)21-18-34-24(26-21)27-25(32)30-14-12-28(13-15-30)17-23(31)29-10-5-4-6-11-29/h9-10,17,19-20H,2-8,11-16,18H2,1H3,(H,28,29,34);7-9,18H,3-6,10-17,19H2,1-2H3,(H,27,28,33);9-10,17,19H,3-8,11-16,18H2,1-2H3,(H,27,28,33);9-10,19-20H,3-8,11-18H2,1-2H3,(H,27,28,32);7-8,18-19H,3-6,9-17H2,1-2H3,(H,26,27,31);2*8-9,16,18H,3-7,10-15,17H2,1-2H3,(H,26,27,32)
InChIKeyMJJUSCLVKXDPKS-UHFFFAOYSA-N
MW3439.66 g/mol
LogP28.83
Rot. Bonds53

About N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)

N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide) (PubChem CID 159584101) has the molecular formula C180H257N35O21S6 and a molecular weight of 3439.66 g/mol. Its IUPAC name is N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide).

Molecular Properties

Compound NameN-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)
PubChem CID159584101
Molecular FormulaC180H257N35O21S6
Molecular Weight3439.66 g/mol
Exact Mass3436.84
IUPAC NameN-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)
SMILESCCCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.CCCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CCN4CCCCC4)CC3)n2)c1.CCCOc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CCN4CCCCC4)CC3)n2)c1.CCCOc1ccc(OC)c(C2=CCC(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)=N2)c1.CCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.CCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.COc1ccc(C2CCCC2)cc1-c1csc(NC(=O)N2CCN(CC(=O)N3CCCCC3)CC2)n1
InChIInChI=1S/C27H37N5O3S.C26H37N5O4.C26H37N5O3S.C26H39N5O2S.C25H37N5O3S.2C25H35N5O3S/c1-35-24-10-9-21(20-7-3-4-8-20)17-22(24)23-19-36-26(28-23)29-27(34)32-15-13-30(14-16-32)18-25(33)31-11-5-2-6-12-31;1-3-17-35-20-7-9-23(34-2)21(18-20)22-8-10-24(27-22)28-26(33)31-15-13-29(14-16-31)19-25(32)30-11-5-4-6-12-30;1-3-4-8-20-9-10-23(34-2)21(17-20)22-19-35-25(27-22)28-26(33)31-15-13-29(14-16-31)18-24(32)30-11-6-5-7-12-30;1-3-4-8-21-9-10-24(33-2)22(19-21)23-20-34-25(27-23)28-26(32)31-17-15-30(16-18-31)14-13-29-11-6-5-7-12-29;1-3-17-33-20-7-8-23(32-2)21(18-20)22-19-34-24(26-22)27-25(31)30-15-13-29(14-16-30)12-11-28-9-5-4-6-10-28;2*1-3-7-19-8-9-22(33-2)20(16-19)21-18-34-24(26-21)27-25(32)30-14-12-28(13-15-30)17-23(31)29-10-5-4-6-11-29/h9-10,17,19-20H,2-8,11-16,18H2,1H3,(H,28,29,34);7-9,18H,3-6,10-17,19H2,1-2H3,(H,27,28,33);9-10,17,19H,3-8,11-16,18H2,1-2H3,(H,27,28,33);9-10,19-20H,3-8,11-18H2,1-2H3,(H,27,28,32);7-8,18-19H,3-6,9-17H2,1-2H3,(H,26,27,31);2*8-9,16,18H,3-7,10-15,17H2,1-2H3,(H,26,27,32)
InChIKeyMJJUSCLVKXDPKS-UHFFFAOYSA-N
XLogP28.83
TPSA529.86 Ų
H-Bond Donors7
H-Bond Acceptors43
Rotatable Bonds53
Heavy Atoms242
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003439.66
LogP ≤ 528.83
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1043

Analyze N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide) with MolForge

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Launch Full Analysis

Related Compounds

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CID 59421411
N-[4-(5-hexyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-pyrrolidin-1-ylethyl)piperazine-1-carboxamide
CID 59421414
N-[4-(5-cyclohexyl-2-ethoxyphenyl)-1,3-thiazol-2-yl]-4-[(1-methylpiperidin-3-yl)methyl]piperazine-1-carboxamide
CID 59421381
(3S)-3-[[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]carbamoyl]piperidine-1-carboxylic acid
CID 87679769
N-[4-(5-butyl-2-ethoxyphenyl)-1,3-thiazol-2-yl]-4-(oxan-4-yl)piperazine-1-carboxamide
CID 23653765
N-[4-(5-cyclohexyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-1-(pyrimidine-4-carbonyl)piperidine-3-carboxamide
CID 11634808
1-N-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethyl]-4-N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]benzene-1,4-dicarboxamide
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N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(3-hydroxypropyl)benzamide
CID 141106168
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 46409422
N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-[4-[(3R)-3-hydroxypyrrolidin-1-yl]piperidine-1-carbonyl]benzamide
CID 87282213
N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(3-oxopropyl)benzamide
CID 87282880
4-[4-[(3S)-3-acetyl-2-aminopyrrolidin-1-yl]piperidine-1-carbonyl]-N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 142755620

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)?
The IUPAC name of N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide) (CID 159584101) is N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide).
What is the SMILES notation for N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)?
The canonical SMILES for N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide) is CCCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.CCCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CCN4CCCCC4)CC3)n2)c1.CCCOc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CCN4CCCCC4)CC3)n2)c1.CCCOc1ccc(OC)c(C2=CCC(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)=N2)c1.CCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.CCCc1ccc(OC)c(-c2csc(NC(=O)N3CCN(CC(=O)N4CCCCC4)CC3)n2)c1.COc1ccc(C2CCCC2)cc1-c1csc(NC(=O)N2CCN(CC(=O)N3CCCCC3)CC2)n1.
What is the InChIKey of N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)?
The InChIKey is MJJUSCLVKXDPKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H37N5O3S.C26H37N5O4.C26H37N5O3S.C26H39N5O2S.C25H37N5O3S.2C25H35N5O3S/c1-35-24-10-9-21(20-7-3-4-8-20)17-22(24)23-19-36-26(28-23)29-27(34)32-15-13-30(14-16-32)18-25(33)31-11-5-2-6-12-31;1-3-17-35-20-7-9-23(34-2)21(18-20)22-8-10-24(27-22)28-26(33)31-15-13-29(14-16-31)19-25(32)30-11-5-4-6-12-30;1-3-4-8-20-9-10-23(34-2)21(17-20)22-19-35-25(27-22)28-26(33)31-15-13-29(14-16-31)18-24(32)30-11-6-5-7-12-30;1-3-4-8-21-9-10-24(33-2)22(19-21)23-20-34-25(27-23)28-26(32)31-17-15-30(16-18-31)14-13-29-11-6-5-7-12-29;1-3-17-33-20-7-8-23(32-2)21(18-20)22-19-34-24(26-22)27-25(31)30-15-13-29(14-16-30)12-11-28-9-5-4-6-10-28;2*1-3-7-19-8-9-22(33-2)20(16-19)21-18-34-24(26-21)27-25(32)30-14-12-28(13-15-30)17-23(31)29-10-5-4-6-11-29/h9-10,17,19-20H,2-8,11-16,18H2,1H3,(H,28,29,34);7-9,18H,3-6,10-17,19H2,1-2H3,(H,27,28,33);9-10,17,19H,3-8,11-16,18H2,1-2H3,(H,27,28,33);9-10,19-20H,3-8,11-18H2,1-2H3,(H,27,28,32);7-8,18-19H,3-6,9-17H2,1-2H3,(H,26,27,31);2*8-9,16,18H,3-7,10-15,17H2,1-2H3,(H,26,27,32).
What are the key properties of N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide)?
N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide) has a molecular weight of 3439.66 g/mol, XLogP of 28.83, 53 rotatable bonds, 7 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-butyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(5-cyclopentyl-2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[5-(2-methoxy-5-propoxyphenyl)-3H-pyrrol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide;N-[4-(2-methoxy-5-propoxyphenyl)-1,3-thiazol-2-yl]-4-(2-piperidin-1-ylethyl)piperazine-1-carboxamide;bis(N-[4-(2-methoxy-5-propylphenyl)-1,3-thiazol-2-yl]-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide) is sourced from PubChem (CID 159584101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).