(2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide

C23H24N2O2S — CID 71170093

IUPAC(2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide
SMILESCOc1ccc(C(SC[C@H](N)C(N)=O)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H24N2O2S/c1-27-20-14-12-19(13-15-20)23(17-8-4-2-5-9-17,18-10-6-3-7-11-18)28-16-21(24)22(25)26/h2-15,21H,16,24H2,1H3,(H2,25,26)/t21-/m0/s1
InChIKeyFZHTUTSKHRUFFE-NRFANRHFSA-N
MW392.52 g/mol
LogP3.53
Rot. Bonds8

About (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide

(2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide (PubChem CID 71170093) has the molecular formula C23H24N2O2S and a molecular weight of 392.52 g/mol. Its IUPAC name is (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide
PubChem CID71170093
Molecular FormulaC23H24N2O2S
Molecular Weight392.52 g/mol
Exact Mass392.16
IUPAC Name(2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide
SMILESCOc1ccc(C(SC[C@H](N)C(N)=O)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C23H24N2O2S/c1-27-20-14-12-19(13-15-20)23(17-8-4-2-5-9-17,18-10-6-3-7-11-18)28-16-21(24)22(25)26/h2-15,21H,16,24H2,1H3,(H2,25,26)/t21-/m0/s1
InChIKeyFZHTUTSKHRUFFE-NRFANRHFSA-N
XLogP3.53
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.52
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-amino-3-tritylsulfanylpropanamide;sulfuric acid
CID 170847509
methyl (2R)-2-acetamido-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanoate
CID 25014751
(2R)-2-amino-3-[diphenyl-(4-phenylphenyl)methyl]sulfanylpropanoic acid
CID 51356551
(2R)-2-amino-3-[(4-hydroxyphenyl)-diphenylmethyl]sulfanylpropanoic acid
CID 24860496
tert-butyl (2S)-2-amino-3-tritylsulfanylpropanoate;hydrochloride
CID 131697882
(2R)-2-amino-3-[(2-methoxyphenyl)-diphenylmethyl]sulfanylpropanoic acid
CID 67126813
2-amino-3-[(3,4-dimethylphenyl)-diphenylmethyl]sulfanylpropanoic acid
CID 71664710
2-[bis(4-methoxyphenyl)-phenylmethyl]sulfanylethanamine
CID 71339520
(2R)-2-[(2R)-2-acetamido-3-[(4-methoxyphenyl)-(4-methylphenyl)-phenylmethyl]sulfanylpropanoyl]oxypropanoic acid
CID 160782438
2-[[(2R)-2-amino-3-tritylsulfanylpropanoyl]amino]propanoic acid
CID 24860491
tert-butyl N-[(2R)-2-amino-3-tritylsulfanylpropanoyl]carbamate
CID 57173848
3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanal
CID 143030464

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide?
The IUPAC name of (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide (CID 71170093) is (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide.
What is the SMILES notation for (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide?
The canonical SMILES for (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide is COc1ccc(C(SC[C@H](N)C(N)=O)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide?
The InChIKey is FZHTUTSKHRUFFE-NRFANRHFSA-N. The full InChI is InChI=1S/C23H24N2O2S/c1-27-20-14-12-19(13-15-20)23(17-8-4-2-5-9-17,18-10-6-3-7-11-18)28-16-21(24)22(25)26/h2-15,21H,16,24H2,1H3,(H2,25,26)/t21-/m0/s1.
What are the key properties of (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide?
(2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide has a molecular weight of 392.52 g/mol, XLogP of 3.53, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-[(4-methoxyphenyl)-diphenylmethyl]sulfanylpropanamide is sourced from PubChem (CID 71170093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).